A0A087XZD9_POEFO Loading...

Ornithine aminotransferase, mitochondrial

Catalyzes the reversible interconversion of L-ornithine and 2-oxoglutarate to L-glutamate semialdehyde and L-glutamate.

AlphaFold DB , UniProt , Accession A0A087XZD9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 492 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32	Very low	27.4	Very low	246 Å²	246	142.3 Å²	142.3	100%	1.212	83%	0.829	S	S	*	*				0	119.7	0	-81.8	172.4	-176.3	0	0	107
2	E	30.1	Very low	27.5	Very low	197 Å²	197	145.8 Å²	145.8	92%	0.921	83%	0.831	S	S	*	*			trans	58	107	164.8	-68.3	178.8	169.8	0	0	121.3
3	T	24.8	Very low	27.7	Very low	126 Å²	126	150.8 Å²	150.8	77%	0.773	84%	0.837	S	S	*	*			trans	-77	151.9	160.1	41	0	0	0	0	113.6
4	C	23.8	Very low	27.9	Very low	121 Å²	121	152.8 Å²	152.8	82%	0.818	84%	0.837	S	S	*	*				-173.3	111.6	129	-105	0	0	0	0	107.6
5	V	27	Very low	28.1	Very low	125 Å²	125	150.5 Å²	150.5	76%	0.758	83%	0.833	S	S	*	*				61.4	126.2	65.8	-174.5	0	0	0	0	109.9
6	S	26.8	Very low	28.1	Very low	94 Å²	94	153 Å²	153	66%	0.657	84%	0.836	S	S	*	*			cis	-169.3	163.1	13.5	44	0	0	0	0	106.8
7	T	27.8	Very low	28.2	Very low	131 Å²	131	157.4 Å²	157.4	80%	0.804	84%	0.838	S	S	*	*				-177.5	149.6	67.6	23.3	0	0	0	0	110.7
8	D	26.9	Very low	28.1	Very low	148 Å²	148	162.3 Å²	162.3	79%	0.791	84%	0.843	S	S	*	*			trans	-53.3	156	170.5	-71.4	-61.8	0	0	0	115.5
9	V	27.4	Very low	28	Very low	141 Å²	141	163.5 Å²	163.5	86%	0.855	84%	0.844	S	S	*	*				-155.4	123.2	111.8	175.5	0	0	0	0	109.4
10	S	26.7	Very low	28.1	Very low	95 Å²	95	161.7 Å²	161.7	66%	0.664	84%	0.84	S	S	*	*			trans	-76.2	144.5	169.4	51.5	0	0	0	0	111.9
11	T	27.9	Very low	28.1	Very low	141 Å²	141	157.5 Å²	157.5	87%	0.865	84%	0.836	S	S	*	*			trans	-151.3	118.1	142.4	36.8	0	0	0	0	110.8
12	H	28.7	Very low	27.9	Very low	185 Å²	185	154.3 Å²	154.3	86%	0.856	82%	0.818	S	S	*	*			trans	-56.1	141.5	162.8	-78.5	-77.6	0	0	0	111.4
13	K	29.8	Very low	27.8	Very low	210 Å²	210	150.3 Å²	150.3	91%	0.913	81%	0.812	S	S	*	*			trans	-127.5	122.9	151.8	-86.6	-173.5	176.4	178.1	0	109.5
14	E	30.6	Very low	28.1	Very low	179 Å²	179	152 Å²	152	84%	0.836	82%	0.816	S	S	*	*			trans	-65.2	155.8	-176.1	-65.3	174.9	136.4	0	0	113.3
15	P	31.4	Very low	28.4	Very low	118 Å²	118	153.6 Å²	153.6	77%	0.766	82%	0.817	S	S	*	*			trans	-74	130.9	166.2	30	-30.8	0	0	0	110.5	R17	P15-R17 PolarHBondContact O-N 3.49Å; P15-R17 VanDerWaalsContact O-N 3.11Å
16	Q	28.5	Very low	28.8	Very low	191 Å²	191	152.1 Å²	152.1	89%	0.893	81%	0.81	S	S	*	*			trans	-60.6	115.5	175	-74.3	-165.2	-26	0	0	110.8
17	R	28.6	Very low	29.2	Very low	228 Å²	228	156 Å²	156	86%	0.86	82%	0.817	S	S	*	*			trans	-72.4	131.3	166.9	-76.2	-179.8	177.5	177.2	0.1	109.6	P15 H19	P15-R17 PolarHBondContact O-N 3.49Å; P15-R17 VanDerWaalsContact O-N 3.11Å; R17-H19 PolarHBondContact O-N 3Å
18	W	26.2	Very low	29.4	Very low	245 Å²	245	161.2 Å²	161.2	93%	0.928	82%	0.822	S	S	*	*			trans	-74.3	115.3	162.6	-71.3	82.8	0	0	0	108.9	V20	W18-V20 PolarHBondContact O-N 3.36Å
19	H	27.9	Very low	29.9	Very low	185 Å²	185	162.3 Å²	162.3	86%	0.856	83%	0.828	S	S	*	*			trans	-79	111.6	166.3	-90.8	-62.3	0	0	0	109.3	R17 G21	R17-H19 PolarHBondContact O-N 3Å; H19-G21 PolarHBondContact O-N 3.5Å
20	V	29.6	Very low	30.1	Very low	128 Å²	128	160.3 Å²	160.3	78%	0.776	82%	0.82	S	S	*	*			trans	-78.1	100.9	162.4	178.9	0	0	0	0	107.2	W18 Q22	W18-V20 PolarHBondContact O-N 3.36Å; V20-Q22 PolarHBondContact O-N 3.43Å
21	G	26.7	Very low	30.5	Very low	73 Å²	73	162.5 Å²	162.5	75%	0.753	83%	0.83	S	S	*	*			trans	-79.2	106.8	165.4	0	0	0	0	0	109.4	H19 S23	H19-G21 PolarHBondContact O-N 3.5Å; G21-S23 PolarHBondContact O-N 3.46Å
22	Q	28.5	Very low	30.4	Very low	179 Å²	179	160.7 Å²	160.7	84%	0.836	82%	0.823	S	S	*	*			trans	-75.1	117	162.1	-78.3	-175	-16.6	0	0	108.6	V20	V20-Q22 PolarHBondContact O-N 3.43Å
23	S	27.6	Very low	30.4	Very low	114 Å²	114	158.8 Å²	158.8	80%	0.797	82%	0.817	S	S	*	*			trans	-115.1	108	157.4	68.5	0	0	0	0	108.8	G21	G21-S23 PolarHBondContact O-N 3.46Å
24	N	32.3	Very low	30.2	Very low	161 Å²	161	155.3 Å²	155.3	86%	0.861	81%	0.808	S	S	*	*			trans	-73.3	118.3	163.4	-88.2	-20.4	0	0	0	108.8
25	N	30.3	Very low	29.9	Very low	154 Å²	154	155.7 Å²	155.7	82%	0.824	81%	0.807	S	S	*	*			trans	-153.3	124.1	144.8	-148.1	4	0	0	0	109.7
26	P	35.3	Very low	29.6	Very low	94 Å²	94	159.6 Å²	159.6	61%	0.61	81%	0.812	S	S	*	*			trans	-82.9	158.2	179.7	33.3	-27.8	0	0	0	110.4
27	H	34.6	Very low	29.4	Very low	176 Å²	176	155.2 Å²	155.2	82%	0.815	80%	0.802	S	S	*	*			trans	86.3	99.1	177.2	-49.8	-69.8	0	0	0	116.7
28	R	31.3	Very low	29.1	Very low	240 Å²	240	155.2 Å²	155.2	91%	0.906	80%	0.803	S	S	*	*				177	129.5	109.1	-96.5	174.3	179.7	-161.1	0.1	110.8	S30	R28-S30 PolarHBondContact O-N 2.95Å
29	N	39.1	Very low	29.1	Very low	172 Å²	172	149.3 Å²	149.3	92%	0.92	79%	0.793	S	S	*	*			trans	-63.3	123.9	162.7	-79.8	-17.8	0	0	0	109.5
30	S	31.1	Very low	29	Very low	99 Å²	99	144.4 Å²	144.4	69%	0.692	78%	0.78	S	S	*	*			trans	-161.7	123.3	153.7	51.1	0	0	0	0	110.7	R28 S32	R28-S30 PolarHBondContact O-N 2.95Å; S30-S32 PolarHBondContact O-N 3.31Å
31	T	33.6	Very low	28.8	Very low	141 Å²	141	146.6 Å²	146.6	87%	0.865	78%	0.782	S	S	*	*			trans	-55	116.9	172.1	-37	0	0	0	0	110.7
32	S	26.8	Very low	29	Very low	103 Å²	103	151.4 Å²	151.4	72%	0.72	78%	0.784	S	S	*	*			trans	-94.5	107.5	175.1	-62	0	0	0	0	110.2	S30	S30-S32 PolarHBondContact O-N 3.31Å
33	I	28.2	Very low	29	Very low	144 Å²	144	151.5 Å²	151.5	74%	0.738	79%	0.785	S	S	*	*			trans	-79.4	118.1	163.2	-64.9	171.5	0	0	0	106.7	F35	I33-F35 HydrophobicContact CG2-CD2 4.19Å; I33-F35 HydrophobicContact CG2-CE2 4.25Å
34	I	26.8	Very low	29	Very low	138 Å²	138	155 Å²	155	71%	0.708	79%	0.789	S	S	*	*			trans	-92	113.7	176.4	-61.6	175.8	0	0	0	108.4	F36	I34-F36 HydrophobicContact CG2-CD2 4.42Å; I34-F36 HydrophobicContact CG2-CE2 4.3Å
35	F	23	Very low	28.8	Very low	186 Å²	186	159.4 Å²	159.4	82%	0.816	79%	0.793	S	S	*	*			trans	-86.4	129.2	163.4	-94.5	-93	0	0	0	109.2	I33	I33-F35 HydrophobicContact CG2-CD2 4.19Å; I33-F35 HydrophobicContact CG2-CE2 4.25Å
36	F	25.5	Very low	28.6	Very low	200 Å²	200	155.3 Å²	155.3	88%	0.877	79%	0.787	S	S	*	*			trans	-86.3	118	165.2	-85.9	-87.4	0	0	0	109.4	I34	I34-F36 HydrophobicContact CG2-CD2 4.42Å; I34-F36 HydrophobicContact CG2-CE2 4.3Å
37	S	23.8	Very low	28.2	Very low	99 Å²	99	160.8 Å²	160.8	69%	0.692	80%	0.801	S	S	*	*			trans	-109.9	118.4	168.5	153.4	0	0	0	0	108.1
38	W	23.8	Very low	28.5	Very low	228 Å²	228	157.2 Å²	157.2	86%	0.864	79%	0.794	S	S	*	*			trans	-87.4	113.1	172.9	-163.4	75.7	0	0	0	108.5	S40	W38-S40 VanDerWaalsContact CZ3-CB 3.46Å
39	V	24.4	Very low	28.3	Very low	121 Å²	121	153.6 Å²	153.6	73%	0.733	79%	0.793	S	S	*	*			trans	-101.3	121.2	172.6	177.6	0	0	0	0	107.6
40	S	26.2	Very low	27.6	Very low	83 Å²	83	150.1 Å²	150.1	58%	0.58	78%	0.781	S	S	*	*			trans	-115	115.1	171.4	163	0	0	0	0	108.3	W38	W38-S40 VanDerWaalsContact CZ3-CB 3.46Å
41	E	26.8	Very low	27.3	Very low	173 Å²	173	154.8 Å²	154.8	81%	0.808	79%	0.789	S	S	*	*			trans	-98.5	118.2	164.4	-97.2	179.5	162.5	0	0	108.3
42	H	30.1	Very low	26.9	Very low	174 Å²	174	155.1 Å²	155.1	81%	0.806	78%	0.784	S	S	*	*			trans	-168.2	118.6	134.8	-100.5	-53.6	0	0	0	113.1
43	Q	28.3	Very low	26.8	Very low	182 Å²	182	159.5 Å²	159.5	85%	0.85	79%	0.791	S	S	*	*			trans	52.8	120.3	141.5	-91.7	173.7	-20.2	0	0	123.5
44	Q	27.4	Very low	26.7	Very low	187 Å²	187	158.9 Å²	158.9	87%	0.874	79%	0.794	S	S	*	*			trans	-47.3	139.1	168.4	-61.9	170.2	-13.8	0	0	116.6
45	R	28.6	Very low	26.7	Very low	254 Å²	254	162 Å²	162	96%	0.958	81%	0.806	S	S	*	*			trans	-152.3	110.8	131.9	-70.4	-161.9	-179.3	169	-0.2	111.8
46	G	25.6	Very low	27	Very low	67 Å²	67	158.1 Å²	158.1	69%	0.691	81%	0.807	S	S	*	*			trans	70	99.1	133.1	0	0	0	0	0	123.8
47	F	27.6	Very low	27.2	Very low	209 Å²	209	154 Å²	154	92%	0.917	80%	0.804	S	S	*	*				74.3	154.6	129	-81.7	-65	0	0	0	122.1
48	P	39.8	Very low	27.4	Very low	101 Å²	101	158.7 Å²	158.7	66%	0.656	82%	0.817	S	S	*	*				-118.1	166.8	-106	42.2	-31.4	0	0	0	114.3
49	N	27.9	Very low	27.7	Very low	165 Å²	165	157.7 Å²	157.7	88%	0.882	82%	0.819	S	S	*	*			trans	-163.2	129	133.2	-95.5	-25.8	0	0	0	110.9
50	C	24.6	Very low	27.9	Very low	98 Å²	98	155.4 Å²	155.4	66%	0.662	82%	0.82	S	S	*	*			trans	-110.1	127.6	-172.4	-160.7	0	0	0	0	108
51	F	25.3	Very low	27.9	Very low	198 Å²	198	160.9 Å²	160.9	87%	0.868	84%	0.838	S	S	*	*			trans	-145.1	103.6	157.5	-92.9	-77.2	0	0	0	109.2
52	L	25	Very low	28.1	Very low	147 Å²	147	159.7 Å²	159.7	77%	0.77	84%	0.836	S	S	*	*			trans	-86.2	132.1	165.5	-91.7	143.1	0	0	0	108.5
53	F	24.5	Very low	28.2	Very low	196 Å²	196	159.8 Å²	159.8	86%	0.86	84%	0.835	S	S	*	*			trans	-110.6	120.9	161.3	-99.7	-85.2	0	0	0	109.2
54	T	26.6	Very low	28.4	Very low	131 Å²	131	158 Å²	158	80%	0.804	83%	0.827	S	S	*	*			trans	-85.2	141.3	172.5	37.8	0	0	0	0	110.8
55	Q	26.7	Very low	28.6	Very low	204 Å²	204	157 Å²	157	95%	0.953	83%	0.826	S	S	*	*			trans	-76.3	137.8	168	-82.3	-179.7	-26.8	0	0	110.6
56	A	28	Very low	28.5	Very low	103 Å²	103	148.8 Å²	148.8	85%	0.851	82%	0.82	S	S	*	*			trans	-123.6	128.1	164.3	0	0	0	0	0	110
57	S	30.9	Very low	28.8	Very low	115 Å²	115	150.7 Å²	150.7	80%	0.804	82%	0.823	S	S	*	*			trans	-85.6	149.5	171.6	78.5	0	0	0	0	110.9
58	M	26.8	Very low	29	Very low	197 Å²	197	148 Å²	148	97%	0.97	82%	0.817	S	S	*	*			trans	-139.4	129.2	158.9	-104.7	-177.1	162.4	0	0	111.9
59	K	30.3	Very low	28.6	Very low	207 Å²	207	148 Å²	148	90%	0.9	82%	0.82	S	S	*	*			trans	-90.3	139	172.1	-78.8	177.6	172.4	178.2	0	110.2
60	G	28.5	Very low	28.9	Very low	73 Å²	73	151.7 Å²	151.7	75%	0.753	82%	0.821	S	S	*	*				80.9	126.5	127.6	0	0	0	0	0	120.4
61	M	26.9	Very low	29.5	Very low	197 Å²	197	152 Å²	152	97%	0.97	83%	0.831	S	S	*	*				-169.9	141.4	127.8	-111.7	173.2	125.4	0	0	111.9
62	I	31.8	Very low	29.7	Very low	148 Å²	148	145.7 Å²	145.7	76%	0.759	82%	0.822	S	S	*	*			trans	-109.9	155.8	177.8	-70.6	170	0	0	0	108.7
63	F	31.3	Very low	30.2	Very low	176 Å²	176	146.6 Å²	146.6	77%	0.772	83%	0.827	S	S	*	*			trans	132.8	142	151.7	-88.7	-95.1	0	0	0	110.4
64	Q	31.5	Very low	30.7	Very low	146 Å²	146	144.2 Å²	144.2	68%	0.682	82%	0.822	S	S	*	*			cis	-167	146.3	-12.5	-138.9	-173.3	-0.7	0	0	108.7
65	L	32.9	Very low	31.2	Very low	166 Å²	166	144.7 Å²	144.7	87%	0.869	82%	0.818	S	S	*	*			trans	31.6	134.6	147.2	-69.5	161.2	0	0	0	123.8
66	G	27	Very low	31.6	Very low	81 Å²	81	146 Å²	146	84%	0.835	82%	0.815	S	S	*	*			trans	175	127.4	156	0	0	0	0	0	113.9
67	S	32	Very low	32	Very low	107 Å²	107	152 Å²	152	75%	0.748	82%	0.815	S	S	*	*			trans	-87.7	168.5	-166	59.3	0	0	0	0	117
68	L	31.3	Very low	32.3	Very low	152 Å²	152	150.7 Å²	150.7	80%	0.796	81%	0.806	S	S	*	*			trans	104	109.7	150.2	-69	154.1	0	0	0	120
69	S	31.6	Very low	33	Very low	101 Å²	101	147.2 Å²	147.2	71%	0.706	80%	0.796	S	S	*	*				73.6	129.3	123.8	-65.9	0	0	0	0	123.9
70	R	33.7	Very low	33.4	Very low	242 Å²	242	144.9 Å²	144.9	91%	0.913	79%	0.787	S	S	*	*			trans	80	108.5	146.9	-83.5	-177.1	171.9	-164.9	-2	120.4
71	A	36.3	Very low	34.1	Very low	104 Å²	104	147 Å²	147	86%	0.86	79%	0.786	S	S	*	*				59.5	111.9	123	0	0	0	0	0	119.4
72	G	29.9	Very low	35	Very low	67 Å²	67	149 Å²	149	69%	0.691	78%	0.783	S	S	*	*			trans	-174.8	81.3	161.5	0	0	0	0	0	110.6	I74	G72-I74 PolarHBondContact O-N 3.43Å
73	L	35.3	Very low	35.7	Very low	165 Å²	165	149.7 Å²	149.7	86%	0.864	79%	0.787	S	S	*	*			trans	-71.5	90.9	173.6	-162.7	89.2	0	0	0	108.7	L75	L73-L75 HydrophobicContact CD2-CD1 3.81Å; L73-L75 HydrophobicContact CG-CD1 4.47Å; L73-L75 PolarHBondContact O-N 3.14Å
74	I	36.5	Very low	36.3	Very low	147 Å²	147	152.3 Å²	152.3	75%	0.754	79%	0.792	S	S	*	*			trans	-88	101.7	168.9	-60.8	177.3	0	0	0	107.2	G72 R76	G72-I74 PolarHBondContact O-N 3.43Å; I74-R76 PolarHBondContact O-N 2.99Å
75	L	35.7	Very low	37.2	Very low	140 Å²	140	151.1 Å²	151.1	73%	0.733	80%	0.797	S	S	*	*			trans	-61.6	99.3	164.9	-101.7	96.5	0	0	0	108.7	L73 R77	L73-L75 HydrophobicContact CD2-CD1 3.81Å; L73-L75 HydrophobicContact CG-CD1 4.47Å; L73-L75 PolarHBondContact O-N 3.14Å; L75-R77 PolarHBondContact O-N 3.44Å; L75-R77 VanDerWaalsContact O-N 3.14Å
76	R	35.8	Very low	38	Very low	232 Å²	232	147 Å²	147	88%	0.875	79%	0.787	S	S	*	*			trans	-71.6	100	159	-78.7	-172.8	175	-164.2	-0.6	107.6	I74 S78	I74-R76 PolarHBondContact O-N 2.99Å; R76-S78 PolarHBondContact O-N 3.34Å
77	R	37.1	Very low	39	Very low	230 Å²	230	148.8 Å²	148.8	87%	0.868	78%	0.784	S	S	*	*			trans	-62.7	100	160.5	-85.9	-176.8	170.8	-176.3	-2.2	107.5	L75 V79	L75-R77 PolarHBondContact O-N 3.44Å; L75-R77 VanDerWaalsContact O-N 3.14Å; R77-V79 PolarHBondContact O-N 2.89Å; R77-V79 VanDerWaalsContact O-N 3.16Å
78	S	37.1	Very low	40.1	Very low	86 Å²	86	150 Å²	150	60%	0.601	79%	0.786	S	S	*	*			trans	-71	104.8	163.8	57.3	0	0	0	0	107.4	R76 H80	R76-S78 PolarHBondContact O-N 3.34Å; S78-H80 PolarHBondContact O-N 3.16Å; S78-H80 PolarHBondContact OG-ND1 3.06Å
79	V	39.8	Very low	41.5	Very low	125 Å²	125	148.5 Å²	148.5	76%	0.758	78%	0.784	S	S	*	*			trans	-67.4	92.6	165.3	-176.6	0	0	0	0	105.9	R77 T81	R77-V79 PolarHBondContact O-N 2.89Å; R77-V79 VanDerWaalsContact O-N 3.16Å; V79-T81 PolarHBondContact O-N 2.92Å
80	H	39.4	Very low	43.6	Very low	157 Å²	157	151.3 Å²	151.3	73%	0.727	78%	0.783	S	S	*	*			trans	-71	89.6	163.3	-81.4	56	0	0	0	106.6	S78 R82	S78-H80 PolarHBondContact O-N 3.16Å; S78-H80 PolarHBondContact OG-ND1 3.06Å; H80-R82 VanDerWaalsContact C-N 3.28Å; H80-R82 PolarHBondContact O-N 3.11Å
81	T	43.7	Very low	46.2	Very low	118 Å²	118	147 Å²	147	72%	0.724	77%	0.767	S	S	*	*			trans	-56.9	98.8	159.2	18.3	0	0	0	0	106.9	V79 L83	V79-T81 PolarHBondContact O-N 2.92Å; T81-L83 VanDerWaalsContact C-N 3.31Å; T81-L83 PolarHBondContact O-N 3.4Å
82	R	44.6	Very low	49	Very low	239 Å²	239	144.7 Å²	144.7	90%	0.902	74%	0.742	S	S	*	*			trans	-60.3	101.7	163.9	-69.4	-174.6	-155.6	-157.7	4.2	105.8	H80 R84	H80-R82 VanDerWaalsContact C-N 3.28Å; H80-R82 PolarHBondContact O-N 3.11Å; R82-R84 PolarHBondContact O-N 3.38Å
83	L	46.7	Very low	52.2	Low	163 Å²	163	141.9 Å²	141.9	85%	0.853	71%	0.712	S	S	*	*			trans	-54.5	112.4	162.4	-75.5	161.9	0	0	0	105.8	T81	T81-L83 VanDerWaalsContact C-N 3.31Å; T81-L83 PolarHBondContact O-N 3.4Å
84	R	45.2	Very low	55.1	Low	231 Å²	231	140 Å²	140	87%	0.872	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-55.5	132.4	166.3	-79.5	-178.8	171.5	-174.9	-3.1	106.1	R82 A86	R82-R84 PolarHBondContact O-N 3.38Å; R84-A86 PolarHBondContact O-N 2.97Å
85	P	49.6	Very low	58	Low	120 Å²	120	137.9 Å²	137.9	78%	0.779	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-53.3	131.1	168.8	-9.3	18.8	0	0	0	107.1
86	A	49.2	Very low	60.9	Low	80 Å²	80	133.6 Å²	133.6	66%	0.661	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-51.6	140.2	170.1	0	0	0	0	0	108.1	R84 V88	R84-A86 PolarHBondContact O-N 2.97Å; A86-V88 PolarHBondContact O-N 3.38Å
87	P	48.3	Very low	63.9	Low	119 Å²	119	126 Å²	126	77%	0.773	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-54	120.5	175.1	23.5	-32.6	0	0	0	107.8	T89	P87-T89 PolarHBondContact O-N 2.78Å
88	V	56.1	Low	66.8	Low	132 Å²	132	118 Å²	118	80%	0.8	62%	0.617	S	S	*	*			trans	-63.8	104.2	172.8	-179.2	0	0	0	0	105.3	A86 K90	A86-V88 PolarHBondContact O-N 3.38Å; V88-K90 PolarHBondContact O-N 3.12Å
89	T	60.2	Low	69.6	Low	121 Å²	121	120.3 Å²	120.3	74%	0.742	61%	0.613	S	S	*	*			trans	-60.8	107.1	168.9	47.4	0	0	0	0	106.3	P87 R91	P87-T89 PolarHBondContact O-N 2.78Å; T89-R91 PolarHBondContact O-N 3.34Å
90	K	76.4	Confident	72.4	Confident	159 Å²	159	119.6 Å²	119.6	69%	0.691	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-56.8	123.9	171.8	-78.2	-169.1	171.6	-163.1	0	107.4	V88	V88-K90 PolarHBondContact O-N 3.12Å
91	R	87.4	Confident	75.2	Confident	153 Å²	153	117.8 Å²	117.8	58%	0.577	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-71.8	147.3	176.5	-63.7	174.1	-174.9	161.2	3.3	108.5	T89 E95 V126	T89-R91 PolarHBondContact O-N 3.34Å; R91-E95 WeakPolarHBondContact CA-OE2 3.38Å; R91-V126 WeakPolarHBondContact O-CG2 3.35Å
92	T	95.2	Very high	77.8	Confident	54 Å²	54	120 Å²	120	33%	0.331	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-94.4	157.1	171.8	85.4	0	0	0	0	111.1	E94 E95 I96	T92-E94 VanDerWaalsContact C-N 3.25Å; T92-E94 WeakPolarHBondContact CB-OE2 3.42Å; T92-E94 PolarHBondContact O-N 2.89Å; T92-E94 PolarHBondContact OG1-N 3.09Å; T92-E94 PolarHBondContact OG1-OE2 3.4Å; T92-E95 PolarHBondContact N-OE2 2.99Å; T92-E95 VanDerWaalsContact N-OE2 3.16Å; T92-E95 WeakPolarHBondContact O-CB 3.46Å; T92-E95 PolarHBondContact O-N 2.88Å; T92-E95 PolarHBondContact OG1-N 3.46Å; T92-I96 PolarHBondContact O-N 2.82Å
93	S	96.6	Very high	80.3	Confident	8 Å²	8	115.3 Å²	115.3	6%	0.056	58%	0.581	C	S	.	*	H	α-helix	trans	-52.4	-43.5	172.6	-88.4	0	0	0	0	111.3	E95 I96 Y97 A114 E127	S93-E95 PolarHBondContact O-N 2.69Å; S93-I96 WeakPolarHBondContact O-CB 3.47Å; S93-I96 PolarHBondContact O-N 3.27Å; S93-I96 VanDerWaalsContact O-N 3.11Å; S93-Y97 WeakPolarHBondContact CB-OH 3.46Å; S93-Y97 WeakPolarHBondContact O-CD1 3.46Å; S93-Y97 VanDerWaalsContact O-CD2 3.26Å; S93-Y97 WeakPolarHBondContact O-CD2 3.48Å; S93-Y97 PolarHBondContact O-N 3.14Å; S93-Y97 PolarHBondContact OG-OH 3.15Å; S93-A114 WeakPolarHBondContact OG-CB 3.43Å; S93-E127 VanDerWaalsContact CB-OE1 3.25Å; S93-E127 WeakPolarHBondContact CB-OE1 3.38Å; S93-E127 PolarHBondContact N-OE1 2.99Å; S93-E127 VanDerWaalsContact OG-CD 3.3Å; S93-E127 PolarHBondContact OG-OE1 3.2Å; S93-E127 PolarHBondContact OG-OE2 2.74Å
94	E	97	Very high	82.8	Confident	126 Å²	126	109.1 Å²	109.1	59%	0.589	56%	0.557	S	S	*	*	H	α-helix	trans	-62.6	-39	178.7	-62	77.6	-170.1	0	0	112.7	T92 I96 Y97 A98	T92-E94 VanDerWaalsContact C-N 3.25Å; T92-E94 WeakPolarHBondContact CB-OE2 3.42Å; T92-E94 PolarHBondContact O-N 2.89Å; T92-E94 PolarHBondContact OG1-N 3.09Å; T92-E94 PolarHBondContact OG1-OE2 3.4Å; E94-I96 VanDerWaalsContact C-N 3.25Å; E94-I96 PolarHBondContact O-N 2.75Å; E94-Y97 PolarHBondContact O-N 2.99Å; E94-A98 VanDerWaalsContact O-CB 3.25Å; E94-A98 WeakPolarHBondContact O-CB 3.49Å; E94-A98 PolarHBondContact O-N 2.92Å
95	E	96.9	Very high	85.3	Confident	102 Å²	102	101.9 Å²	101.9	48%	0.477	55%	0.546	S	S	.	.	H	α-helix	trans	-64.4	-33.1	176.1	-65.9	-179.4	142.4	0	0	111.9	R91 T92 S93 R99	R91-E95 WeakPolarHBondContact CA-OE2 3.38Å; T92-E95 PolarHBondContact N-OE2 2.99Å; T92-E95 VanDerWaalsContact N-OE2 3.16Å; T92-E95 WeakPolarHBondContact O-CB 3.46Å; T92-E95 PolarHBondContact O-N 2.88Å; T92-E95 PolarHBondContact OG1-N 3.46Å; S93-E95 PolarHBondContact O-N 2.69Å; E95-R99 WeakPolarHBondContact O-CB 3.36Å; E95-R99 PolarHBondContact O-N 3.15Å
96	I	97.3	Very high	87.5	Confident	51 Å²	51	102 Å²	102	26%	0.262	54%	0.536	S	S	.	.	H	α-helix	trans	-73	-49.6	177.6	-66.7	171	0	0	0	110	T92 S93 E94 A98 R99 E100 A114 V126	T92-I96 PolarHBondContact O-N 2.82Å; S93-I96 WeakPolarHBondContact O-CB 3.47Å; S93-I96 PolarHBondContact O-N 3.27Å; S93-I96 VanDerWaalsContact O-N 3.11Å; E94-I96 VanDerWaalsContact C-N 3.25Å; E94-I96 PolarHBondContact O-N 2.75Å; I96-A98 PolarHBondContact O-N 2.73Å; I96-R99 WeakPolarHBondContact O-CB 3.48Å; I96-R99 PolarHBondContact O-N 3.23Å; I96-R99 VanDerWaalsContact O-N 3.16Å; I96-E100 PolarHBondContact O-N 2.99Å; I96-A114 HydrophobicContact CB-CB 4.19Å; I96-A114 HydrophobicContact CD1-CB 3.77Å; I96-A114 HydrophobicContact CG2-CB 4.1Å; I96-V126 HydrophobicContact CD1-CB 4.19Å; I96-V126 HydrophobicContact CD1-CG1 3.36Å; I96-V126 HydrophobicContact CD1-CG2 3.93Å
97	Y	97.6	Very high	89.8	Confident	72 Å²	72	103.8 Å²	103.8	28%	0.282	53%	0.534	S	S	.	.	H	α-helix	trans	-58.9	-46.7	177.9	-52.4	-29.9	0	0	0	111.3	S93 E94 R99 E100 E101 P112 V113 A114	S93-Y97 WeakPolarHBondContact CB-OH 3.46Å; S93-Y97 WeakPolarHBondContact O-CD1 3.46Å; S93-Y97 VanDerWaalsContact O-CD2 3.26Å; S93-Y97 WeakPolarHBondContact O-CD2 3.48Å; S93-Y97 PolarHBondContact O-N 3.14Å; S93-Y97 PolarHBondContact OG-OH 3.15Å; E94-Y97 PolarHBondContact O-N 2.99Å; Y97-R99 VanDerWaalsContact C-N 3.25Å; Y97-R99 PolarHBondContact O-N 3.36Å; Y97-E100 PolarHBondContact O-N 3.44Å; Y97-E101 WeakPolarHBondContact O-CB 3.27Å; Y97-E101 PolarHBondContact O-N 3.39Å; Y97-P112 HydrophobicContact CE2-CB 4.41Å; Y97-P112 PolarHBondContact OH-O 3.32Å; Y97-V113 VanDerWaalsContact OH-C 3.32Å; Y97-V113 WeakPolarHBondContact OH-CA 3.24Å; Y97-V113 PolarHBondContact OH-N 3.4Å; Y97-A114 HydrophobicContact CE1-CB 3.82Å; Y97-A114 PolarHBondContact OH-N 2.9Å
98	A	97.8	Very high	92	Very high	61 Å²	61	106.5 Å²	106.5	50%	0.504	53%	0.53	S	S	.	.	H	α-helix	trans	-63.3	-32	179.4	0	0	0	0	0	112.7	E94 I96 K102	E94-A98 VanDerWaalsContact O-CB 3.25Å; E94-A98 WeakPolarHBondContact O-CB 3.49Å; E94-A98 PolarHBondContact O-N 2.92Å; I96-A98 PolarHBondContact O-N 2.73Å; A98-K102 VanDerWaalsContact O-CB 3.32Å; A98-K102 WeakPolarHBondContact O-CB 3.27Å; A98-K102 PolarHBondContact O-N 3.46Å; A98-K102 VanDerWaalsContact O-N 3.12Å
99	R	97.6	Very high	93.9	Very high	136 Å²	136	106.4 Å²	106.4	51%	0.513	52%	0.521	S	S	.	.	H	α-helix	trans	-71.5	-43	175.7	-173	179.9	-60.3	176.1	3.7	111.6	E95 I96 Y97 K102 H103	E95-R99 WeakPolarHBondContact O-CB 3.36Å; E95-R99 PolarHBondContact O-N 3.15Å; I96-R99 WeakPolarHBondContact O-CB 3.48Å; I96-R99 PolarHBondContact O-N 3.23Å; I96-R99 VanDerWaalsContact O-N 3.16Å; Y97-R99 VanDerWaalsContact C-N 3.25Å; Y97-R99 PolarHBondContact O-N 3.36Å; R99-K102 PolarHBondContact O-N 2.85Å; R99-H103 WeakPolarHBondContact O-CB 3.42Å; R99-H103 PolarHBondContact O-CD2 3.43Å; R99-H103 PolarHBondContact O-N 3.02Å; R99-H103 VanDerWaalsContact O-N 3.14Å
100	E	97.9	Very high	95.6	Very high	109 Å²	109	103.9 Å²	103.9	51%	0.509	51%	0.507	S	S	.	.	H	α-helix	trans	-64.1	-46.1	175.4	-172.2	175.8	-170.3	0	0	110.8	I96 Y97 K102 H103 G104	I96-E100 PolarHBondContact O-N 2.99Å; Y97-E100 PolarHBondContact O-N 3.44Å; E100-K102 PolarHBondContact O-N 2.96Å; E100-H103 PolarHBondContact O-N 3.35Å; E100-G104 WeakPolarHBondContact O-CA 3.33Å; E100-G104 PolarHBondContact O-N 2.88Å
101	E	97.5	Very high	96.6	Very high	120 Å²	120	97.2 Å²	97.2	56%	0.561	48%	0.479	S	S	*	.	H	α-helix	trans	-54.3	-41.2	174.9	-179.7	63.5	-163.4	0	0	112	Y97 H106	Y97-E101 WeakPolarHBondContact O-CB 3.27Å; Y97-E101 PolarHBondContact O-N 3.39Å; E101-H106 VanDerWaalsContact CD-CE1 3.5Å; E101-H106 PolarHBondContact O-NE2 3.08Å; E101-H106 IonicContact OE1-CE1 3.87Å; E101-H106 PolarHBondContact OE1-CE1 3.33Å; E101-H106 IonicContact OE1-ND1 3.82Å; E101-H106 IonicContact OE1-NE2 2.85Å; E101-H106 IonicContact OE2-CE1 3.74Å; E101-H106 IonicContact OE2-NE2 3.38Å
102	K	98.3	Very high	97	Very high	164 Å²	164	92.4 Å²	92.4	71%	0.713	47%	0.467	S	S	*	.	H	α-helix	trans	-75	-34.4	-177.6	-177.6	175.5	176.9	-179.1	0	113.9	A98 R99 E100	A98-K102 VanDerWaalsContact O-CB 3.32Å; A98-K102 WeakPolarHBondContact O-CB 3.27Å; A98-K102 PolarHBondContact O-N 3.46Å; A98-K102 VanDerWaalsContact O-N 3.12Å; R99-K102 PolarHBondContact O-N 2.85Å; E100-K102 PolarHBondContact O-N 2.96Å
103	H	98.2	Very high	97.2	Very high	140 Å²	140	90.9 Å²	90.9	65%	0.648	46%	0.458	S	S	*	.	H	α-helix	trans	-120.3	-21.6	-165.2	-66.3	-64.2	0	0	0	114.5	R99 E100	R99-H103 WeakPolarHBondContact O-CB 3.42Å; R99-H103 PolarHBondContact O-CD2 3.43Å; R99-H103 PolarHBondContact O-N 3.02Å; R99-H103 VanDerWaalsContact O-N 3.14Å; E100-H103 PolarHBondContact O-N 3.35Å
104	G	98	Very high	97.2	Very high	34 Å²	34	90.9 Å²	90.9	35%	0.351	46%	0.458	S	S	.	.	S	Bend	trans	-88.2	158.5	177.4	0	0	0	0	0	112.3	E100 H106	E100-G104 WeakPolarHBondContact O-CA 3.33Å; E100-G104 PolarHBondContact O-N 2.88Å; G104-H106 PolarHBondContact O-CD2 3.06Å
105	A	97.9	Very high	97.3	Very high	78 Å²	78	89 Å²	89	65%	0.645	45%	0.451	S	S	*	.			trans	-74.1	144.1	167.4	0	0	0	0	0	110	N107	A105-N107 WeakPolarHBondContact CB-OD1 3.49Å; A105-N107 PolarHBondContact O-N 2.96Å; A105-N107 VanDerWaalsContact O-N 3.09Å; A105-N107 PolarHBondContact O-OD1 3.35Å; A105-N107 VanDerWaalsContact O-OD1 3.11Å
106	H	96.9	Very high	97.3	Very high	124 Å²	124	90.3 Å²	90.3	57%	0.574	46%	0.458	S	S	*	.	S	Bend	trans	-89.4	48	-175.6	-58.1	173.4	0	0	0	112.3	E101 G104	E101-H106 VanDerWaalsContact CD-CE1 3.5Å; E101-H106 PolarHBondContact O-NE2 3.08Å; E101-H106 IonicContact OE1-CE1 3.87Å; E101-H106 PolarHBondContact OE1-CE1 3.33Å; E101-H106 IonicContact OE1-ND1 3.82Å; E101-H106 IonicContact OE1-NE2 2.85Å; E101-H106 IonicContact OE2-CE1 3.74Å; E101-H106 IonicContact OE2-NE2 3.38Å; G104-H106 PolarHBondContact O-CD2 3.06Å
107	N	95.9	Very high	97.4	Very high	116 Å²	116	93.1 Å²	93.1	62%	0.62	47%	0.465	S	S	*	.			trans	-98.4	4.7	-176.7	63.6	-68.7	0	0	0	113.6	A105	A105-N107 WeakPolarHBondContact CB-OD1 3.49Å; A105-N107 PolarHBondContact O-N 2.96Å; A105-N107 VanDerWaalsContact O-N 3.09Å; A105-N107 PolarHBondContact O-OD1 3.35Å; A105-N107 VanDerWaalsContact O-OD1 3.11Å
108	Y	95.8	Very high	97.4	Very high	176 Å²	176	90.3 Å²	90.3	69%	0.69	46%	0.458	S	S	*	.			trans	-128.8	153.6	173.6	-79.1	-86.4	0	0	0	110.7
109	H	95	Very high	97.5	Very high	131 Å²	131	92.8 Å²	92.8	61%	0.606	46%	0.459	S	S	*	.			trans	-121.3	85.5	167.9	-176.5	-144.6	0	0	0	108.6	W444 K458	H109-W444 AromaticContact CE1-CH2 3.92Å; H109-W444 AromaticContact CE1-CZ2 3.85Å; H109-W444 AromaticContact NE2-CZ2 3.99Å; H109-K458 VanDerWaalsContact O-CE 3.29Å; H109-K458 WeakPolarHBondContact O-CE 3.48Å
110	P	96.7	Very high	97.5	Very high	68 Å²	68	87.5 Å²	87.5	44%	0.442	45%	0.447	S	S	.	.			trans	-70.4	151.8	-177	-18.4	33.1	0	0	0	112.6
111	L	96.4	Very high	97.6	Very high	19 Å²	19	82.6 Å²	82.6	10%	0.099	42%	0.424	C	S	.	.			trans	-64.4	134.3	163.5	-164.9	73.4	0	0	0	107.7	V113 W444 C447 L448 R451 L456	L111-V113 VanDerWaalsContact C-N 3.31Å; L111-V113 PolarHBondContact O-N 3.01Å; L111-W444 HydrophobicContact CD1-CE3 4.43Å; L111-W444 HydrophobicContact CD1-CH2 3.96Å; L111-W444 HydrophobicContact CD1-CZ2 4.3Å; L111-W444 HydrophobicContact CD1-CZ3 4.01Å; L111-C447 HydrophobicContact CD1-CB 4.19Å; L111-L448 HydrophobicContact CD1-CD2 3.78Å; L111-L448 HydrophobicContact CD1-CG 4.38Å; L111-R451 HydrophobicContact CD2-CB 4.06Å; L111-L456 HydrophobicContact CD2-CD2 4.2Å
112	P	97.1	Very high	97.6	Very high	51 Å²	51	78.8 Å²	78.8	33%	0.331	41%	0.405	S	S	.	.	S	Bend	trans	-72.5	85	-175.1	20.6	-24.3	0	0	0	111.4	Y97 L448 R451	Y97-P112 HydrophobicContact CE2-CB 4.41Å; Y97-P112 PolarHBondContact OH-O 3.32Å; P112-L448 HydrophobicContact CG-CD2 3.86Å; P112-R451 PolarHBondContact O-NH1 2.91Å
113	V	97.9	Very high	97.6	Very high	23 Å²	23	71.1 Å²	71.1	14%	0.139	37%	0.372	C	S	.	.			trans	-151.2	123.3	172.6	58	0	0	0	0	109.3	Y97 L111 L115 D125 Y131 L456	Y97-V113 VanDerWaalsContact OH-C 3.32Å; Y97-V113 WeakPolarHBondContact OH-CA 3.24Å; Y97-V113 PolarHBondContact OH-N 3.4Å; L111-V113 VanDerWaalsContact C-N 3.31Å; L111-V113 PolarHBondContact O-N 3.01Å; V113-L115 HydrophobicContact CG2-CD2 3.78Å; V113-L115 HydrophobicContact CG2-CG 4.42Å; V113-D125 HydrophobicContact CG2-CB 4Å; V113-Y131 HydrophobicContact CG2-CD2 4.5Å; V113-Y131 HydrophobicContact CG2-CE2 3.88Å; V113-L456 HydrophobicContact CG1-CD1 4.05Å; V113-L456 HydrophobicContact CG1-CD2 4.05Å; V113-L456 HydrophobicContact CG2-CD1 4.41Å; V113-L456 HydrophobicContact CG2-CD2 4.48Å
114	A	98	Very high	97.7	Very high	7 Å²	7	66.3 Å²	66.3	6%	0.058	35%	0.348	C	S	.	.			trans	-98.2	95.5	-179.1	0	0	0	0	0	111.2	S93 I96 Y97 D125 V126	S93-A114 WeakPolarHBondContact OG-CB 3.43Å; I96-A114 HydrophobicContact CB-CB 4.19Å; I96-A114 HydrophobicContact CD1-CB 3.77Å; I96-A114 HydrophobicContact CG2-CB 4.1Å; Y97-A114 HydrophobicContact CE1-CB 3.82Å; Y97-A114 PolarHBondContact OH-N 2.9Å; A114-D125 CarbonylContact O-C 3.45Å; A114-D125 WeakPolarHBondContact O-CA 3.48Å; A114-D125 VanDerWaalsContact O-CB 3.3Å; A114-D125 WeakPolarHBondContact O-CB 3.19Å; A114-V126 HydrophobicContact CB-CG1 4.36Å; A114-V126 HydrophobicContact CB-CG2 4.2Å; A114-V126 WeakPolarHBondContact O-CG1 3.49Å; A114-V126 PolarHBondContact O-N 3.17Å
115	L	98.3	Very high	97.7	Very high	86 Å²	86	64.9 Å²	64.9	45%	0.45	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	136.8	-177	-58.4	178.3	0	0	0	112.9	V113 V123 W124 Y131 L456	V113-L115 HydrophobicContact CG2-CD2 3.78Å; V113-L115 HydrophobicContact CG2-CG 4.42Å; L115-V123 HydrophobicContact CD1-CB 4.14Å; L115-V123 HydrophobicContact CD1-CG1 4.39Å; L115-V123 HydrophobicContact CD1-CG2 3.89Å; L115-V123 HydrophobicContact CD2-CB 3.97Å; L115-V123 HydrophobicContact CD2-CG2 3.6Å; L115-V123 HydrophobicContact CG-CG2 4.39Å; L115-W124 WeakPolarHBondContact CA-O 3.46Å; L115-Y131 HydrophobicContact CD2-CD2 4.41Å; L115-L456 HydrophobicContact CD1-CD1 4.11Å; L115-L456 HydrophobicContact CD2-CD1 3.93Å; L115-L456 HydrophobicContact CG-CD1 4.5Å
116	E	97.8	Very high	97.7	Very high	131 Å²	131	61.7 Å²	61.7	61%	0.612	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.8	-19.5	174.6	58.8	169.8	-152.9	0	0	115.1	W124 V126	E116-W124 PolarHBondContact N-O 3.3Å; E116-V126 HydrophobicContact CB-CG1 3.99Å; E116-V126 HydrophobicContact CG-CG1 4.2Å
117	R	98.3	Very high	97.7	Very high	109 Å²	109	59.4 Å²	59.4	41%	0.411	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	142.8	-175.7	-167.8	174.7	75.2	89.8	-8.2	111.1	E119 V123 W124	R117-E119 IonicContact CZ-OE2 2.92Å; R117-E119 IonicContact NH1-OE2 2.68Å; R117-E119 PolarHBondContact NH1-OE2 2.78Å; R117-V123 CarbonylContact O-C 3.54Å; R117-V123 WeakPolarHBondContact O-CA 3.29Å; R117-W124 HydrophobicContact CB-CB 4.32Å; R117-W124 HydrophobicContact CB-CE3 4.3Å; R117-W124 HydrophobicContact CG-CE3 4.31Å; R117-W124 VanDerWaalsContact CZ-CE3 3.43Å; R117-W124 PolarHBondContact N-O 3.25Å; R117-W124 VanDerWaalsContact NH2-CH2 3.27Å; R117-W124 PolarHBondContact O-N 3.14Å
118	G	98.6	Very high	97.7	Very high	14 Å²	14	55.9 Å²	55.9	14%	0.144	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	144.3	171.3	0	0	0	0	0	111.2	Y122 H145	G118-Y122 CarbonylContact C-O 3.54Å; G118-Y122 WeakPolarHBondContact CA-O 3.4Å; G118-H145 VanDerWaalsContact C-CB 3.42Å
119	E	98.7	Very high	97.8	Very high	112 Å²	112	51.6 Å²	51.6	52%	0.523	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	115.5	176.8	-172.7	179.7	173.1	0	0	110	R117 I121 Y122 W124	R117-E119 IonicContact CZ-OE2 2.92Å; R117-E119 IonicContact NH1-OE2 2.68Å; R117-E119 PolarHBondContact NH1-OE2 2.78Å; E119-I121 PolarHBondContact O-N 3.19Å; E119-I121 VanDerWaalsContact O-N 3.15Å; E119-Y122 PolarHBondContact N-O 3.35Å; E119-Y122 PolarHBondContact O-N 3.21Å; E119-W124 HydrophobicContact CB-CH2 4Å; E119-W124 HydrophobicContact CB-CZ3 3.72Å
120	G	98.6	Very high	98	Very high	25 Å²	25	51.1 Å²	51.1	26%	0.258	27%	0.268	S	S	.	.	B	Isolated β-bridge	trans	59.5	-117.4	-178.5	0	0	0	0	0	111.6	G144 H145	G120-G144 CarbonylContact O-C 3.34Å; G120-G144 VanDerWaalsContact O-CA 3.25Å; G120-G144 WeakPolarHBondContact O-CA 3.34Å; G120-H145 PolarHBondContact N-O 2.89Å; G120-H145 PolarHBondContact O-CD2 3.06Å; G120-H145 PolarHBondContact O-N 3.13Å
121	I	98.8	Very high	98.1	Very high	7 Å²	7	48.8 Å²	48.8	4%	0.036	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-1.7	178.9	65.6	178.9	0	0	0	114	E119 Y132 D133 P470 V472 I473 E477	E119-I121 PolarHBondContact O-N 3.19Å; E119-I121 VanDerWaalsContact O-N 3.15Å; I121-Y132 HydrophobicContact CD1-CD1 3.81Å; I121-Y132 HydrophobicContact CD1-CE1 3.54Å; I121-Y132 HydrophobicContact CG1-CD1 4.18Å; I121-Y132 HydrophobicContact CG1-CE1 4.26Å; I121-D133 PolarHBondContact O-N 3.18Å; I121-P470 HydrophobicContact CG2-CB 4.14Å; I121-P470 HydrophobicContact CG2-CG 4.4Å; I121-V472 HydrophobicContact CG2-CG2 3.89Å; I121-I473 HydrophobicContact CD1-CD1 4.3Å; I121-I473 HydrophobicContact CD1-CG1 3.93Å; I121-I473 HydrophobicContact CG2-CB 3.85Å; I121-I473 HydrophobicContact CG2-CG1 4.29Å; I121-E477 HydrophobicContact CD1-CB 3.67Å; I121-E477 HydrophobicContact CD1-CG 3.8Å; I121-E477 WeakPolarHBondContact CD1-OE2 3.3Å
122	Y	98.9	Very high	98.2	Very high	40 Å²	40	48.2 Å²	48.2	16%	0.157	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	148.8	-170.9	-61.2	-64.2	0	0	0	112.5	G118 E119 W124 R130 Y131 Y132	G118-Y122 CarbonylContact C-O 3.54Å; G118-Y122 WeakPolarHBondContact CA-O 3.4Å; E119-Y122 PolarHBondContact N-O 3.35Å; E119-Y122 PolarHBondContact O-N 3.21Å; Y122-W124 HydrophobicContact CD2-CH2 4.43Å; Y122-W124 HydrophobicContact CG-CH2 4.18Å; Y122-R130 HydrophobicContact CD1-CG 4.18Å; Y122-R130 VanDerWaalsContact CD1-NH1 3.31Å; Y122-R130 HydrophobicContact CG-CG 4.48Å; Y122-R130 PolarHBondContact OH-NH1 2.99Å; Y122-Y131 VanDerWaalsContact CA-O 3.28Å; Y122-Y131 WeakPolarHBondContact CA-O 3.28Å; Y122-Y132 HydrophobicContact CD1-CD1 4.02Å; Y122-Y132 HydrophobicContact CD1-CE1 4.14Å; Y122-Y132 HydrophobicContact CD1-CG 4.41Å; Y122-Y132 AromaticContact CE1-CD1 3.42Å; Y122-Y132 HydrophobicContact CE1-CD1 3.42Å; Y122-Y132 VanDerWaalsContact CE1-CD1 3.42Å; Y122-Y132 HydrophobicContact CE1-CD2 4.31Å; Y122-Y132 AromaticContact CE1-CE1 3.12Å; Y122-Y132 HydrophobicContact CE1-CE1 3.12Å; Y122-Y132 HydrophobicContact CE1-CE2 4.05Å; Y122-Y132 HydrophobicContact CE1-CG 4.02Å; Y122-Y132 AromaticContact CE1-CZ 3.45Å; Y122-Y132 VanDerWaalsContact CE1-CZ 3.45Å; Y122-Y132 AromaticContact CZ-CE1 3.54Å; Y122-Y132 AromaticContact CZ-CZ 3.9Å; Y122-Y132 WeakPolarHBondContact OH-CE1 3.48Å; Y122-Y132 PolarHBondContact OH-OH 3.33Å
123	V	98.9	Very high	98.3	Very high	3 Å²	3	46.4 Å²	46.4	2%	0.018	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	155.1	166.5	-62.7	0	0	0	0	110.4	L115 R117 R130 Y131 D133 H145 L456	L115-V123 HydrophobicContact CD1-CB 4.14Å; L115-V123 HydrophobicContact CD1-CG1 4.39Å; L115-V123 HydrophobicContact CD1-CG2 3.89Å; L115-V123 HydrophobicContact CD2-CB 3.97Å; L115-V123 HydrophobicContact CD2-CG2 3.6Å; L115-V123 HydrophobicContact CG-CG2 4.39Å; R117-V123 CarbonylContact O-C 3.54Å; R117-V123 WeakPolarHBondContact O-CA 3.29Å; V123-R130 WeakPolarHBondContact O-CA 3.41Å; V123-Y131 HydrophobicContact CG2-CD2 4.44Å; V123-Y131 PolarHBondContact N-O 3.15Å; V123-Y131 PolarHBondContact O-N 2.97Å; V123-D133 HydrophobicContact CG1-CB 4.3Å; V123-H145 WeakPolarHBondContact CG1-NE2 3.37Å; V123-L456 HydrophobicContact CG2-CD1 3.69Å
124	W	98.8	Very high	98.3	Very high	38 Å²	38	45.3 Å²	45.3	14%	0.144	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	139	177	-64.9	-105.6	0	0	0	110.4	L115 E116 R117 E119 Y122 N129 R130	L115-W124 WeakPolarHBondContact CA-O 3.46Å; E116-W124 PolarHBondContact N-O 3.3Å; R117-W124 HydrophobicContact CB-CB 4.32Å; R117-W124 HydrophobicContact CB-CE3 4.3Å; R117-W124 HydrophobicContact CG-CE3 4.31Å; R117-W124 VanDerWaalsContact CZ-CE3 3.43Å; R117-W124 PolarHBondContact N-O 3.25Å; R117-W124 VanDerWaalsContact NH2-CH2 3.27Å; R117-W124 PolarHBondContact O-N 3.14Å; E119-W124 HydrophobicContact CB-CH2 4Å; E119-W124 HydrophobicContact CB-CZ3 3.72Å; Y122-W124 HydrophobicContact CD2-CH2 4.43Å; Y122-W124 HydrophobicContact CG-CH2 4.18Å; W124-N129 WeakPolarHBondContact CA-O 3.36Å; W124-R130 HydrophobicContact CD2-CG 4.19Å; W124-R130 VanDerWaalsContact CE2-CG 3.49Å; W124-R130 HydrophobicContact CG-CB 4.4Å; W124-R130 HydrophobicContact CG-CG 4.49Å; W124-R130 HydrophobicContact CZ2-CG 3.75Å
125	D	98.4	Very high	98.4	Very high	5 Å²	5	46.4 Å²	46.4	3%	0.027	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	173.1	170.4	72.3	9	0	0	0	112.4	V113 A114 E127 G128 N129 Y131	V113-D125 HydrophobicContact CG2-CB 4Å; A114-D125 CarbonylContact O-C 3.45Å; A114-D125 WeakPolarHBondContact O-CA 3.48Å; A114-D125 VanDerWaalsContact O-CB 3.3Å; A114-D125 WeakPolarHBondContact O-CB 3.19Å; D125-E127 PolarHBondContact O-N 3.47Å; D125-E127 WeakPolarHBondContact OD1-CA 3.34Å; D125-E127 WeakPolarHBondContact OD1-CB 3.35Å; D125-E127 PolarHBondContact OD1-N 3Å; D125-E127 VanDerWaalsContact OD1-N 3.15Å; D125-G128 PolarHBondContact O-N 3.22Å; D125-G128 PolarHBondContact OD1-N 2.74Å; D125-N129 PolarHBondContact N-O 3.16Å; D125-N129 WeakPolarHBondContact OD1-CB 3.27Å; D125-N129 PolarHBondContact OD1-N 2.83Å; D125-N129 PolarHBondContact OD1-ND2 3.12Å; D125-N129 WeakPolarHBondContact OD2-CB 3.2Å; D125-N129 PolarHBondContact OD2-ND2 3.1Å; D125-Y131 HydrophobicContact CB-CE2 3.99Å; D125-Y131 PolarHBondContact OD2-OH 3.4Å
126	V	97.9	Very high	98.4	Very high	10 Å²	10	42.3 Å²	42.3	6%	0.061	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-20.3	-178.9	-58.3	0	0	0	0	113.9	R91 I96 A114 E116 G128	R91-V126 WeakPolarHBondContact O-CG2 3.35Å; I96-V126 HydrophobicContact CD1-CB 4.19Å; I96-V126 HydrophobicContact CD1-CG1 3.36Å; I96-V126 HydrophobicContact CD1-CG2 3.93Å; A114-V126 HydrophobicContact CB-CG1 4.36Å; A114-V126 HydrophobicContact CB-CG2 4.2Å; A114-V126 WeakPolarHBondContact O-CG1 3.49Å; A114-V126 PolarHBondContact O-N 3.17Å; E116-V126 HydrophobicContact CB-CG1 3.99Å; E116-V126 HydrophobicContact CG-CG1 4.2Å; V126-G128 VanDerWaalsContact C-N 3.33Å
127	E	96.4	Very high	98.3	Very high	76 Å²	76	38.5 Å²	38.5	36%	0.355	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-19.3	171.3	-70.4	73.6	-155.8	0	0	112.6	S93 D125	S93-E127 VanDerWaalsContact CB-OE1 3.25Å; S93-E127 WeakPolarHBondContact CB-OE1 3.38Å; S93-E127 PolarHBondContact N-OE1 2.99Å; S93-E127 VanDerWaalsContact OG-CD 3.3Å; S93-E127 PolarHBondContact OG-OE1 3.2Å; S93-E127 PolarHBondContact OG-OE2 2.74Å; D125-E127 PolarHBondContact O-N 3.47Å; D125-E127 WeakPolarHBondContact OD1-CA 3.34Å; D125-E127 WeakPolarHBondContact OD1-CB 3.35Å; D125-E127 PolarHBondContact OD1-N 3Å; D125-E127 VanDerWaalsContact OD1-N 3.15Å
128	G	96.9	Very high	98.3	Very high	43 Å²	43	36.5 Å²	36.5	44%	0.443	20%	0.195	S	C	.	.			trans	97.8	8.5	179.4	0	0	0	0	0	114.6	D125 V126	D125-G128 PolarHBondContact O-N 3.22Å; D125-G128 PolarHBondContact OD1-N 2.74Å; V126-G128 VanDerWaalsContact C-N 3.33Å
129	N	98.3	Very high	98.3	Very high	86 Å²	86	36 Å²	36	46%	0.46	19%	0.189	S	C	.	.			trans	-67.4	139.8	171.4	-56.1	-54.3	0	0	0	109.6	W124 D125 Y131	W124-N129 WeakPolarHBondContact CA-O 3.36Å; D125-N129 PolarHBondContact N-O 3.16Å; D125-N129 WeakPolarHBondContact OD1-CB 3.27Å; D125-N129 PolarHBondContact OD1-N 2.83Å; D125-N129 PolarHBondContact OD1-ND2 3.12Å; D125-N129 WeakPolarHBondContact OD2-CB 3.2Å; D125-N129 PolarHBondContact OD2-ND2 3.1Å; N129-Y131 HydrophobicContact CB-CE2 3.71Å; N129-Y131 VanDerWaalsContact CB-OH 3.28Å; N129-Y131 WeakPolarHBondContact CB-OH 3.43Å; N129-Y131 WeakPolarHBondContact O-CE2 3.08Å
130	R	98.6	Very high	98.3	Very high	120 Å²	120	31.3 Å²	31.3	45%	0.453	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	139	179.6	-175.3	177	62.8	107	4.1	110	Y122 V123 W124	Y122-R130 HydrophobicContact CD1-CG 4.18Å; Y122-R130 VanDerWaalsContact CD1-NH1 3.31Å; Y122-R130 HydrophobicContact CG-CG 4.48Å; Y122-R130 PolarHBondContact OH-NH1 2.99Å; V123-R130 WeakPolarHBondContact O-CA 3.41Å; W124-R130 HydrophobicContact CD2-CG 4.19Å; W124-R130 VanDerWaalsContact CE2-CG 3.49Å; W124-R130 HydrophobicContact CG-CB 4.4Å; W124-R130 HydrophobicContact CG-CG 4.49Å; W124-R130 HydrophobicContact CZ2-CG 3.75Å
131	Y	98.9	Very high	98.3	Very high	19 Å²	19	30.6 Å²	30.6	8%	0.075	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	148.8	178.3	-48.7	-92.4	0	0	0	112.2	V113 L115 Y122 V123 D125 N129 R451 G454 L456	V113-Y131 HydrophobicContact CG2-CD2 4.5Å; V113-Y131 HydrophobicContact CG2-CE2 3.88Å; L115-Y131 HydrophobicContact CD2-CD2 4.41Å; Y122-Y131 VanDerWaalsContact CA-O 3.28Å; Y122-Y131 WeakPolarHBondContact CA-O 3.28Å; V123-Y131 HydrophobicContact CG2-CD2 4.44Å; V123-Y131 PolarHBondContact N-O 3.15Å; V123-Y131 PolarHBondContact O-N 2.97Å; D125-Y131 HydrophobicContact CB-CE2 3.99Å; D125-Y131 PolarHBondContact OD2-OH 3.4Å; N129-Y131 HydrophobicContact CB-CE2 3.71Å; N129-Y131 VanDerWaalsContact CB-OH 3.28Å; N129-Y131 WeakPolarHBondContact CB-OH 3.43Å; N129-Y131 WeakPolarHBondContact O-CE2 3.08Å; Y131-R451 HydrophobicContact CE1-CG 3.89Å; Y131-R451 VanDerWaalsContact CE1-O 3.22Å; Y131-R451 WeakPolarHBondContact CE1-O 3.5Å; Y131-G454 CarbonylContact C-O 3.57Å; Y131-G454 VanDerWaalsContact CA-O 3.25Å; Y131-G454 WeakPolarHBondContact CA-O 2.72Å; Y131-L456 HydrophobicContact CD1-CD2 3.67Å; Y131-L456 HydrophobicContact CD1-CG 4.03Å; Y131-L456 HydrophobicContact CD2-CD1 4.28Å; Y131-L456 HydrophobicContact CE1-CD2 4.15Å; Y131-L456 HydrophobicContact CG-CD1 4.05Å; Y131-L456 HydrophobicContact CG-CD2 3.94Å; Y131-L456 HydrophobicContact CG-CG 3.82Å
132	Y	98.9	Very high	98.3	Very high	8 Å²	8	30.3 Å²	30.3	3%	0.031	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	128	157.5	-72.2	-80.8	0	0	0	109.4	I121 Y122 G454 L456 E477 E480 C481 I484	I121-Y132 HydrophobicContact CD1-CD1 3.81Å; I121-Y132 HydrophobicContact CD1-CE1 3.54Å; I121-Y132 HydrophobicContact CG1-CD1 4.18Å; I121-Y132 HydrophobicContact CG1-CE1 4.26Å; Y122-Y132 HydrophobicContact CD1-CD1 4.02Å; Y122-Y132 HydrophobicContact CD1-CE1 4.14Å; Y122-Y132 HydrophobicContact CD1-CG 4.41Å; Y122-Y132 AromaticContact CE1-CD1 3.42Å; Y122-Y132 HydrophobicContact CE1-CD1 3.42Å; Y122-Y132 VanDerWaalsContact CE1-CD1 3.42Å; Y122-Y132 HydrophobicContact CE1-CD2 4.31Å; Y122-Y132 AromaticContact CE1-CE1 3.12Å; Y122-Y132 HydrophobicContact CE1-CE1 3.12Å; Y122-Y132 HydrophobicContact CE1-CE2 4.05Å; Y122-Y132 HydrophobicContact CE1-CG 4.02Å; Y122-Y132 AromaticContact CE1-CZ 3.45Å; Y122-Y132 VanDerWaalsContact CE1-CZ 3.45Å; Y122-Y132 AromaticContact CZ-CE1 3.54Å; Y122-Y132 AromaticContact CZ-CZ 3.9Å; Y122-Y132 WeakPolarHBondContact OH-CE1 3.48Å; Y122-Y132 PolarHBondContact OH-OH 3.33Å; Y132-G454 PolarHBondContact N-O 2.95Å; Y132-L456 PolarHBondContact O-N 3.4Å; Y132-E477 HydrophobicContact CE1-CB 4.12Å; Y132-E480 HydrophobicContact CE2-CB 4.43Å; Y132-E480 PolarHBondContact OH-OE2 2.9Å; Y132-C481 WeakPolarHBondContact CD1-SG 3.43Å; Y132-I484 HydrophobicContact CD2-CD1 4.07Å; Y132-I484 HydrophobicContact CE2-CD1 4.21Å
133	D	98.9	Very high	98.3	Very high	12 Å²	12	28.6 Å²	28.6	6%	0.064	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	111	173.5	-179.6	5.6	0	0	0	110.2	I121 V123 L135 S136 H145 P469 P470	I121-D133 PolarHBondContact O-N 3.18Å; V123-D133 HydrophobicContact CG1-CB 4.3Å; D133-L135 WeakPolarHBondContact OD1-CA 3.25Å; D133-L135 PolarHBondContact OD1-N 3.05Å; D133-S136 PolarHBondContact OD1-N 3.47Å; D133-S136 WeakPolarHBondContact OD2-CA 2.93Å; D133-S136 PolarHBondContact OD2-N 3.38Å; D133-H145 IonicContact OD2-CD2 2.75Å; D133-H145 IonicContact OD2-CE1 2.92Å; D133-H145 PolarHBondContact OD2-CE1 3.27Å; D133-H145 IonicContact OD2-NE2 2.74Å; D133-H145 PolarHBondContact OD2-NE2 3.35Å; D133-P469 WeakPolarHBondContact O-CA 3.43Å; D133-P470 VanDerWaalsContact O-CD 3.27Å; D133-P470 WeakPolarHBondContact O-CD 3.42Å
134	F	98.7	Very high	98.3	Very high	1 Å²	1	28.4 Å²	28.4	0%	0.004	15%	0.151	C	C	.	.	S	Bend	trans	-106.4	15.7	176.5	-95.3	-119.6	0	0	0	112.7	L409 L455 L456 A457 L467 A468 P469 I473 L478 C481 I485	F134-L409 HydrophobicContact CE1-CD2 4.45Å; F134-L455 HydrophobicContact CB-CD2 3.77Å; F134-L455 HydrophobicContact CB-CG 4.23Å; F134-L455 HydrophobicContact CD1-CD1 4.26Å; F134-L455 HydrophobicContact CD1-CD2 4.43Å; F134-L455 HydrophobicContact CD2-CD1 3.77Å; F134-L455 HydrophobicContact CD2-CD2 4.3Å; F134-L455 HydrophobicContact CD2-CG 3.88Å; F134-L455 HydrophobicContact CE1-CD1 4.35Å; F134-L455 HydrophobicContact CE2-CD1 3.9Å; F134-L455 HydrophobicContact CE2-CG 4.47Å; F134-L455 HydrophobicContact CG-CD1 3.98Å; F134-L455 HydrophobicContact CG-CD2 3.92Å; F134-L455 HydrophobicContact CG-CG 4.01Å; F134-L455 HydrophobicContact CZ-CD1 4.18Å; F134-L456 CarbonylContact C-O 2.95Å; F134-L456 VanDerWaalsContact CA-O 3.31Å; F134-L456 WeakPolarHBondContact CA-O 2.88Å; F134-L456 VanDerWaalsContact CB-O 3.26Å; F134-L456 WeakPolarHBondContact CB-O 3.49Å; F134-L456 PolarHBondContact N-O 2.99Å; F134-A457 HydrophobicContact CB-CB 4.42Å; F134-L467 HydrophobicContact CB-CD2 4.44Å; F134-L467 HydrophobicContact CD1-CB 3.95Å; F134-L467 HydrophobicContact CD1-CD2 3.78Å; F134-L467 HydrophobicContact CD1-CG 4.44Å; F134-A468 CarbonylContact C-O 3.5Å; F134-A468 CarbonylContact O-C 3.57Å; F134-A468 PolarHBondContact O-N 3.1Å; F134-P469 HydrophobicContact CD1-CG 4.41Å; F134-P469 HydrophobicContact CD2-CB 3.87Å; F134-P469 HydrophobicContact CE1-CB 4.46Å; F134-P469 HydrophobicContact CE1-CG 4.1Å; F134-P469 HydrophobicContact CE2-CB 3.75Å; F134-P469 HydrophobicContact CE2-CG 4.17Å; F134-P469 HydrophobicContact CG-CB 4.25Å; F134-P469 HydrophobicContact CZ-CB 4.07Å; F134-P469 HydrophobicContact CZ-CG 3.96Å; F134-I473 HydrophobicContact CE2-CD1 4.33Å; F134-I473 HydrophobicContact CZ-CD1 4.45Å; F134-L478 HydrophobicContact CZ-CD1 4.15Å; F134-C481 HydrophobicContact CE1-CB 4.36Å; F134-C481 HydrophobicContact CE2-CB 3.67Å; F134-C481 WeakPolarHBondContact CE2-SG 3.37Å; F134-C481 HydrophobicContact CZ-CB 3.38Å; F134-I485 HydrophobicContact CD1-CD1 4.47Å; F134-I485 HydrophobicContact CE1-CD1 4.07Å
135	L	98.3	Very high	98.3	Very high	29 Å²	29	28.4 Å²	28.4	15%	0.152	15%	0.153	C	C	.	.	S	Bend	trans	-109.6	-34.3	171.3	-165.4	65.4	0	0	0	111.9	D133 A137 Y138 S139 K458 A468	D133-L135 WeakPolarHBondContact OD1-CA 3.25Å; D133-L135 PolarHBondContact OD1-N 3.05Å; L135-A137 PolarHBondContact O-N 3.07Å; L135-Y138 HydrophobicContact CD1-CD1 3.71Å; L135-Y138 HydrophobicContact CD1-CE1 3.69Å; L135-Y138 HydrophobicContact CD2-CD1 4.32Å; L135-Y138 HydrophobicContact CD2-CE1 3.93Å; L135-Y138 HydrophobicContact CD2-CE2 4.35Å; L135-Y138 HydrophobicContact CG-CD1 4.07Å; L135-Y138 HydrophobicContact CG-CE1 4.12Å; L135-Y138 WeakPolarHBondContact O-CA 3.32Å; L135-Y138 PolarHBondContact O-N 3.46Å; L135-S139 PolarHBondContact O-N 3.27Å; L135-K458 HydrophobicContact CD1-CB 4.25Å; L135-K458 HydrophobicContact CD2-CB 4.3Å; L135-A468 CarbonylContact C-O 3.58Å
136	S	98.2	Very high	98.3	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	50.2	40	-176	-53.1	0	0	0	0	112.9	D133 Y138 S139 A140 V141 A468 P469 P470	D133-S136 PolarHBondContact OD1-N 3.47Å; D133-S136 WeakPolarHBondContact OD2-CA 2.93Å; D133-S136 PolarHBondContact OD2-N 3.38Å; S136-Y138 VanDerWaalsContact C-N 3.27Å; S136-Y138 PolarHBondContact O-N 2.93Å; S136-S139 CarbonylContact O-C 3.59Å; S136-S139 PolarHBondContact O-N 3.24Å; S136-S139 VanDerWaalsContact O-N 3.13Å; S136-A140 PolarHBondContact O-N 3.06Å; S136-V141 PolarHBondContact O-N 2.83Å; S136-A468 WeakPolarHBondContact CB-O 3.2Å; S136-A468 PolarHBondContact N-O 3.01Å; S136-A468 PolarHBondContact OG-O 3.39Å; S136-P469 WeakPolarHBondContact OG-CA 3.43Å; S136-P469 PolarHBondContact OG-O 3.15Å; S136-P470 WeakPolarHBondContact OG-CD 3.35Å
137	A	97.6	Very high	98.4	Very high	52 Å²	52	33 Å²	33	43%	0.43	18%	0.182	S	C	.	.	H	α-helix	trans	45.2	51.3	-169.7	0	0	0	0	0	112.6	L135 A140 V141	L135-A137 PolarHBondContact O-N 3.07Å; A137-A140 HydrophobicContact CB-CB 4.26Å; A137-A140 WeakPolarHBondContact O-CB 3.45Å; A137-A140 PolarHBondContact O-N 3.02Å; A137-V141 HydrophobicContact CB-CG2 3.99Å
138	Y	97.8	Very high	98.5	Very high	66 Å²	66	34 Å²	34	26%	0.259	20%	0.195	S	C	.	.	H	α-helix	trans	61.7	42.7	-179	-50.9	-73	0	0	0	114	L135 S136 Q319 K345 R466	L135-Y138 HydrophobicContact CD1-CD1 3.71Å; L135-Y138 HydrophobicContact CD1-CE1 3.69Å; L135-Y138 HydrophobicContact CD2-CD1 4.32Å; L135-Y138 HydrophobicContact CD2-CE1 3.93Å; L135-Y138 HydrophobicContact CD2-CE2 4.35Å; L135-Y138 HydrophobicContact CG-CD1 4.07Å; L135-Y138 HydrophobicContact CG-CE1 4.12Å; L135-Y138 WeakPolarHBondContact O-CA 3.32Å; L135-Y138 PolarHBondContact O-N 3.46Å; S136-Y138 VanDerWaalsContact C-N 3.27Å; S136-Y138 PolarHBondContact O-N 2.93Å; Y138-Q319 PolarHBondContact O-NE2 2.59Å; Y138-Q319 VanDerWaalsContact O-NE2 3.07Å; Y138-K345 WeakPolarHBondContact O-CD 3.45Å; Y138-K345 PolarHBondContact O-NZ 3.46Å; Y138-K345 VanDerWaalsContact O-NZ 3.09Å; Y138-R466 VanDerWaalsContact CE1-NH2 3.33Å
139	S	98.3	Very high	98.6	Very high	3 Å²	3	35 Å²	35	2%	0.021	19%	0.187	C	C	.	.	H	α-helix	trans	71.6	25.2	-175.9	-46.9	0	0	0	0	115.5	L135 S136 N142 R324 A346	L135-S139 PolarHBondContact O-N 3.27Å; S136-S139 CarbonylContact O-C 3.59Å; S136-S139 PolarHBondContact O-N 3.24Å; S136-S139 VanDerWaalsContact O-N 3.13Å; S139-N142 PolarHBondContact O-OD1 2.96Å; S139-N142 VanDerWaalsContact O-OD1 3.06Å; S139-R324 PolarHBondContact OG-NE 3.45Å; S139-A346 WeakPolarHBondContact O-CB 3.26Å
140	A	98.6	Very high	98.6	Very high	15 Å²	15	30.9 Å²	30.9	12%	0.124	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-25.1	170.5	0	0	0	0	0	113.3	S136 A137 N142 K345 A346 G349 G350	S136-A140 PolarHBondContact O-N 3.06Å; A137-A140 HydrophobicContact CB-CB 4.26Å; A137-A140 WeakPolarHBondContact O-CB 3.45Å; A137-A140 PolarHBondContact O-N 3.02Å; A140-N142 PolarHBondContact O-N 2.82Å; A140-K345 HydrophobicContact CB-CB 3.89Å; A140-K345 HydrophobicContact CB-CG 4.33Å; A140-A346 VanDerWaalsContact O-CA 3.3Å; A140-A346 WeakPolarHBondContact O-CA 3.47Å; A140-G349 CarbonylContact O-C 3.45Å; A140-G349 VanDerWaalsContact O-C 3.23Å; A140-G350 PolarHBondContact O-N 2.97Å
141	V	98.8	Very high	98.6	Very high	9 Å²	9	27.6 Å²	27.6	6%	0.055	16%	0.158	C	C	.	.			trans	-102.5	49.9	-175.5	-166	0	0	0	0	110.3	S136 A137 Q143 G144 H145 P470	S136-V141 PolarHBondContact O-N 2.83Å; A137-V141 HydrophobicContact CB-CG2 3.99Å; V141-Q143 VanDerWaalsContact C-N 3.26Å; V141-Q143 PolarHBondContact O-N 2.86Å; V141-G144 PolarHBondContact O-N 3.41Å; V141-H145 HydrophobicContact CG1-CB 4.46Å; V141-P470 VanDerWaalsContact O-CB 3.29Å; V141-P470 WeakPolarHBondContact O-CB 3.42Å
142	N	98.9	Very high	98.6	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-37.2	-179.5	-73.9	5.2	0	0	0	111.7	S139 A140 G144 L322 R324 A346 L471	S139-N142 PolarHBondContact O-OD1 2.96Å; S139-N142 VanDerWaalsContact O-OD1 3.06Å; A140-N142 PolarHBondContact O-N 2.82Å; N142-G144 VanDerWaalsContact C-N 3.27Å; N142-G144 PolarHBondContact O-N 3.16Å; N142-L322 PolarHBondContact ND2-O 3.47Å; N142-R324 VanDerWaalsContact OD1-CZ 3.27Å; N142-R324 PolarHBondContact OD1-NE 3.36Å; N142-R324 VanDerWaalsContact OD1-NE 3.08Å; N142-R324 PolarHBondContact OD1-NH2 2.96Å; N142-A346 HydrophobicContact CB-CB 3.75Å; N142-A346 VanDerWaalsContact ND2-CB 3.29Å; N142-A346 WeakPolarHBondContact ND2-CB 3.43Å; N142-L471 HydrophobicContact CB-CD1 3.74Å; N142-L471 HydrophobicContact CB-CG 3.85Å; N142-L471 WeakPolarHBondContact O-CA 3.41Å; N142-L471 WeakPolarHBondContact O-CB 3.25Å; N142-L471 PolarHBondContact O-N 3.25Å
143	Q	98.8	Very high	98.6	Very high	4 Å²	4	29.1 Å²	29.1	2%	0.019	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-0.7	-177.1	-61.9	87	-25.9	0	0	113.4	V141 H147 I150 A346 A389 V392 L398 V472	V141-Q143 VanDerWaalsContact C-N 3.26Å; V141-Q143 PolarHBondContact O-N 2.86Å; Q143-H147 HydrophobicContact CB-CB 4.5Å; Q143-H147 PolarHBondContact O-CD2 2.69Å; Q143-I150 HydrophobicContact CB-CD1 3.8Å; Q143-I150 HydrophobicContact CG-CD1 3.91Å; Q143-A346 PolarHBondContact NE2-O 2.96Å; Q143-A389 PolarHBondContact NE2-O 3.01Å; Q143-V392 HydrophobicContact CB-CG1 3.95Å; Q143-V392 HydrophobicContact CG-CB 4.16Å; Q143-V392 HydrophobicContact CG-CG1 3.72Å; Q143-L398 HydrophobicContact CG-CD1 4.02Å; Q143-V472 WeakPolarHBondContact O-CG1 3.32Å
144	G	98.8	Very high	98.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.182	C	C	.	.			trans	86.2	153.3	-174.2	0	0	0	0	0	113.6	G120 V141 N142 C146	G120-G144 CarbonylContact O-C 3.34Å; G120-G144 VanDerWaalsContact O-CA 3.25Å; G120-G144 WeakPolarHBondContact O-CA 3.34Å; V141-G144 PolarHBondContact O-N 3.41Å; N142-G144 VanDerWaalsContact C-N 3.27Å; N142-G144 PolarHBondContact O-N 3.16Å; G144-C146 PolarHBondContact O-N 2.82Å
145	H	98.9	Very high	98.6	Very high	38 Å²	38	34.3 Å²	34.3	18%	0.176	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-61.8	134.4	-178	-73.5	-80.7	0	0	0	111.1	G118 G120 V123 D133 V141 H147	G118-H145 VanDerWaalsContact C-CB 3.42Å; G120-H145 PolarHBondContact N-O 2.89Å; G120-H145 PolarHBondContact O-CD2 3.06Å; G120-H145 PolarHBondContact O-N 3.13Å; V123-H145 WeakPolarHBondContact CG1-NE2 3.37Å; D133-H145 IonicContact OD2-CD2 2.75Å; D133-H145 IonicContact OD2-CE1 2.92Å; D133-H145 PolarHBondContact OD2-CE1 3.27Å; D133-H145 IonicContact OD2-NE2 2.74Å; D133-H145 PolarHBondContact OD2-NE2 3.35Å; V141-H145 HydrophobicContact CG1-CB 4.46Å; H145-H147 PolarHBondContact O-N 3Å
146	C	98.5	Very high	98.6	Very high	84 Å²	84	39.7 Å²	39.7	57%	0.568	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	37.5	175.1	-62.8	0	0	0	0	114.3	G144 V151	G144-C146 PolarHBondContact O-N 2.82Å; C146-V151 HydrophobicContact CB-CG2 4.35Å
147	H	98.9	Very high	98.7	Very high	26 Å²	26	40.5 Å²	40.5	12%	0.12	23%	0.231	C	C	.	.			trans	-51.7	123.2	179.9	-168.9	-84.2	0	0	0	111.9	Q143 H145 K149 I150 V151 V392 E396	Q143-H147 HydrophobicContact CB-CB 4.5Å; Q143-H147 PolarHBondContact O-CD2 2.69Å; H145-H147 PolarHBondContact O-N 3Å; H147-K149 VanDerWaalsContact C-N 3.32Å; H147-K149 PolarHBondContact ND1-N 3.03Å; H147-K149 PolarHBondContact O-N 2.87Å; H147-I150 HydrophobicContact CB-CB 4.37Å; H147-I150 HydrophobicContact CB-CD1 3.95Å; H147-I150 HydrophobicContact CB-CG1 4.07Å; H147-I150 PolarHBondContact O-N 2.8Å; H147-V151 PolarHBondContact O-N 3.27Å; H147-V392 WeakPolarHBondContact CE1-CG2 3.39Å; H147-E396 IonicContact CE1-OE1 2.73Å; H147-E396 IonicContact NE2-OE1 2.77Å; H147-E396 PolarHBondContact NE2-OE1 3.14Å
148	P	98.8	Very high	98.7	Very high	98 Å²	98	40.5 Å²	40.5	64%	0.636	23%	0.231	S	C	*	.	H	α-helix	trans	-61.8	-36.7	-165.8	21.3	-33.3	0	0	0	113.3	I150 S152	P148-I150 PolarHBondContact O-N 3.21Å; P148-S152 WeakPolarHBondContact O-CB 3.37Å; P148-S152 PolarHBondContact O-N 3.29Å
149	K	98.9	Very high	98.7	Very high	64 Å²	64	42.1 Å²	42.1	28%	0.278	25%	0.251	S	S	.	.	H	α-helix	trans	-63.1	-41.1	176.6	-175.7	167	170.6	176.5	0	112	H147 A153 E391 V392 E395	H147-K149 VanDerWaalsContact C-N 3.32Å; H147-K149 PolarHBondContact ND1-N 3.03Å; H147-K149 PolarHBondContact O-N 2.87Å; K149-A153 PolarHBondContact O-N 3.28Å; K149-A153 VanDerWaalsContact O-N 3.1Å; K149-E391 WeakPolarHBondContact CE-OE2 3.49Å; K149-E391 IonicContact NZ-OE2 3.14Å; K149-E391 PolarHBondContact NZ-OE2 3.49Å; K149-V392 HydrophobicContact CB-CG2 4Å; K149-V392 HydrophobicContact CD-CG2 3.84Å; K149-V392 HydrophobicContact CG-CG2 4.17Å; K149-E395 IonicContact NZ-OE1 2.8Å; K149-E395 PolarHBondContact NZ-OE1 2.8Å; K149-E395 IonicContact NZ-OE2 3.91Å; K149-E395 PolarHBondContact NZ-OE2 2.74Å
150	I	98.9	Very high	98.8	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-75.1	-45.4	-177.7	-53.4	179.9	0	0	0	110.3	Q143 H147 P148 S152 A153 L154 V351 V385 A389 V392	Q143-I150 HydrophobicContact CB-CD1 3.8Å; Q143-I150 HydrophobicContact CG-CD1 3.91Å; H147-I150 HydrophobicContact CB-CB 4.37Å; H147-I150 HydrophobicContact CB-CD1 3.95Å; H147-I150 HydrophobicContact CB-CG1 4.07Å; H147-I150 PolarHBondContact O-N 2.8Å; P148-I150 PolarHBondContact O-N 3.21Å; I150-S152 VanDerWaalsContact C-N 3.31Å; I150-S152 PolarHBondContact O-N 2.88Å; I150-A153 WeakPolarHBondContact O-CB 3.24Å; I150-A153 PolarHBondContact O-N 3.49Å; I150-A153 VanDerWaalsContact O-N 3.12Å; I150-L154 PolarHBondContact O-N 3.25Å; I150-V351 HydrophobicContact CB-CG2 4.43Å; I150-V351 HydrophobicContact CG2-CB 4.02Å; I150-V351 HydrophobicContact CG2-CG1 4.46Å; I150-V351 HydrophobicContact CG2-CG2 3.73Å; I150-V385 HydrophobicContact CG2-CG1 3.84Å; I150-A389 HydrophobicContact CD1-CB 3.84Å; I150-A389 HydrophobicContact CG1-CB 4.38Å; I150-V392 HydrophobicContact CG1-CG2 4.23Å
151	V	98.9	Very high	98.8	Very high	50 Å²	50	49.9 Å²	49.9	30%	0.303	29%	0.294	S	S	.	.	H	α-helix	trans	-62	-39	176.6	174.8	0	0	0	0	111.4	C146 H147 L154 T155	C146-V151 HydrophobicContact CB-CG2 4.35Å; H147-V151 PolarHBondContact O-N 3.27Å; V151-L154 PolarHBondContact O-N 3.03Å; V151-T155 WeakPolarHBondContact O-CB 3.29Å; V151-T155 PolarHBondContact O-N 2.87Å; V151-T155 PolarHBondContact O-OG1 3.2Å
152	S	98.8	Very high	98.7	Very high	41 Å²	41	51.7 Å²	51.7	29%	0.287	31%	0.31	S	S	.	.	H	α-helix	trans	-62	-44.2	172.8	166.2	0	0	0	0	111.5	P148 I150 T155 K156	P148-S152 WeakPolarHBondContact O-CB 3.37Å; P148-S152 PolarHBondContact O-N 3.29Å; I150-S152 VanDerWaalsContact C-N 3.31Å; I150-S152 PolarHBondContact O-N 2.88Å; S152-T155 PolarHBondContact O-N 3.15Å; S152-K156 WeakPolarHBondContact O-CB 3.44Å; S152-K156 VanDerWaalsContact O-CG 3.27Å; S152-K156 WeakPolarHBondContact O-CG 3.13Å; S152-K156 PolarHBondContact O-N 2.68Å; S152-K156 VanDerWaalsContact OG-CE 3.24Å; S152-K156 WeakPolarHBondContact OG-CE 3.37Å; S152-K156 PolarHBondContact OG-NZ 3.45Å
153	A	98.9	Very high	98.7	Very high	19 Å²	19	54.8 Å²	54.8	16%	0.157	33%	0.326	C	S	.	.	H	α-helix	trans	-61.3	-45.6	178.1	0	0	0	0	0	111.7	K149 I150 Q157 A388	K149-A153 PolarHBondContact O-N 3.28Å; K149-A153 VanDerWaalsContact O-N 3.1Å; I150-A153 WeakPolarHBondContact O-CB 3.24Å; I150-A153 PolarHBondContact O-N 3.49Å; I150-A153 VanDerWaalsContact O-N 3.12Å; A153-Q157 WeakPolarHBondContact O-CB 3.47Å; A153-Q157 PolarHBondContact O-N 3.25Å; A153-Q157 VanDerWaalsContact O-N 3.08Å; A153-A388 HydrophobicContact CB-CB 3.61Å
154	L	98.8	Very high	98.7	Very high	45 Å²	45	55.9 Å²	55.9	24%	0.236	33%	0.334	C	S	.	.	H	α-helix	trans	-54.4	-57.2	173	176.4	73.8	0	0	0	110.9	I150 V151 K156 Q157 A158 V351 Y352 V381 V385	I150-L154 PolarHBondContact O-N 3.25Å; V151-L154 PolarHBondContact O-N 3.03Å; L154-K156 PolarHBondContact O-N 2.84Å; L154-Q157 PolarHBondContact O-N 2.88Å; L154-A158 WeakPolarHBondContact O-CB 3.3Å; L154-A158 PolarHBondContact O-N 3.33Å; L154-V351 HydrophobicContact CB-CG1 4.17Å; L154-V351 HydrophobicContact CD1-CG1 4.44Å; L154-V351 HydrophobicContact CD2-CG1 3.6Å; L154-V351 HydrophobicContact CG-CG1 4.27Å; L154-Y352 HydrophobicContact CD1-CD2 3.79Å; L154-Y352 HydrophobicContact CD1-CE2 4.36Å; L154-V381 HydrophobicContact CD1-CG1 3.47Å; L154-V381 VanDerWaalsContact CD1-CG1 3.47Å; L154-V385 HydrophobicContact CB-CG2 3.73Å; L154-V385 HydrophobicContact CD1-CG2 3.9Å; L154-V385 HydrophobicContact CG-CG2 4.46Å
155	T	98.8	Very high	98.6	Very high	76 Å²	76	57.8 Å²	57.8	47%	0.466	35%	0.347	S	S	.	.	H	α-helix	trans	-64.4	-43.2	-171.1	-54	0	0	0	0	111.8	V151 S152 S159	V151-T155 WeakPolarHBondContact O-CB 3.29Å; V151-T155 PolarHBondContact O-N 2.87Å; V151-T155 PolarHBondContact O-OG1 3.2Å; S152-T155 PolarHBondContact O-N 3.15Å; T155-S159 WeakPolarHBondContact O-CB 3.47Å; T155-S159 PolarHBondContact O-N 3.16Å; T155-S159 VanDerWaalsContact O-N 3.12Å; T155-S159 PolarHBondContact O-OG 3.31Å
156	K	98.8	Very high	98.5	Very high	142 Å²	142	62 Å²	62	62%	0.617	36%	0.361	S	S	*	.	H	α-helix	trans	-64.5	-47.9	178.5	-72.8	174.1	179.4	172	0	111.6	S152 L154 S159 T160	S152-K156 WeakPolarHBondContact O-CB 3.44Å; S152-K156 VanDerWaalsContact O-CG 3.27Å; S152-K156 WeakPolarHBondContact O-CG 3.13Å; S152-K156 PolarHBondContact O-N 2.68Å; S152-K156 VanDerWaalsContact OG-CE 3.24Å; S152-K156 WeakPolarHBondContact OG-CE 3.37Å; S152-K156 PolarHBondContact OG-NZ 3.45Å; L154-K156 PolarHBondContact O-N 2.84Å; K156-S159 PolarHBondContact O-N 3.48Å; K156-T160 PolarHBondContact O-N 3.34Å; K156-T160 PolarHBondContact O-OG1 3.49Å
157	Q	98.8	Very high	98.4	Very high	18 Å²	18	61.8 Å²	61.8	8%	0.084	37%	0.365	C	S	.	.	H	α-helix	trans	-69.5	-39.9	-178.2	-171.9	58.7	51.7	0	0	111.7	A153 L154 S159 T160 L161 P380 V381 R384	A153-Q157 WeakPolarHBondContact O-CB 3.47Å; A153-Q157 PolarHBondContact O-N 3.25Å; A153-Q157 VanDerWaalsContact O-N 3.08Å; L154-Q157 PolarHBondContact O-N 2.88Å; Q157-S159 VanDerWaalsContact C-N 3.25Å; Q157-S159 PolarHBondContact O-N 2.79Å; Q157-T160 PolarHBondContact O-N 3.41Å; Q157-L161 PolarHBondContact NE2-O 2.93Å; Q157-L161 CarbonylContact O-C 3.55Å; Q157-L161 PolarHBondContact O-N 2.93Å; Q157-P380 HydrophobicContact CG-CB 4.2Å; Q157-P380 WeakPolarHBondContact CG-O 3.27Å; Q157-V381 HydrophobicContact CB-CG2 4.16Å; Q157-V381 HydrophobicContact CG-CB 4.41Å; Q157-V381 HydrophobicContact CG-CG2 3.83Å; Q157-R384 HydrophobicContact CB-CB 4.02Å; Q157-R384 HydrophobicContact CB-CG 3.93Å; Q157-R384 HydrophobicContact CG-CB 4.09Å; Q157-R384 HydrophobicContact CG-CG 3.72Å
158	A	98.6	Very high	98.4	Very high	52 Å²	52	67.7 Å²	67.7	43%	0.43	39%	0.391	S	S	.	.	H	α-helix	trans	-62.9	-32.7	176.9	0	0	0	0	0	112.5	L154 T160 V381	L154-A158 WeakPolarHBondContact O-CB 3.3Å; L154-A158 PolarHBondContact O-N 3.33Å; A158-T160 PolarHBondContact O-N 3.38Å; A158-V381 HydrophobicContact CB-CG2 4.11Å
159	S	98.5	Very high	98.4	Very high	100 Å²	100	74.1 Å²	74.1	70%	0.699	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-7.9	174.5	-54.8	0	0	0	0	113.6	T155 K156 Q157	T155-S159 WeakPolarHBondContact O-CB 3.47Å; T155-S159 PolarHBondContact O-N 3.16Å; T155-S159 VanDerWaalsContact O-N 3.12Å; T155-S159 PolarHBondContact O-OG 3.31Å; K156-S159 PolarHBondContact O-N 3.48Å; Q157-S159 VanDerWaalsContact C-N 3.25Å; Q157-S159 PolarHBondContact O-N 2.79Å
160	T	98.7	Very high	98.3	Very high	112 Å²	112	72 Å²	72	69%	0.687	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	-63.1	-178.1	-54.7	0	0	0	0	110.9	K156 Q157 A158	K156-T160 PolarHBondContact O-N 3.34Å; K156-T160 PolarHBondContact O-OG1 3.49Å; Q157-T160 PolarHBondContact O-N 3.41Å; A158-T160 PolarHBondContact O-N 3.38Å
161	L	98.7	Very high	98.3	Very high	68 Å²	68	77.9 Å²	77.9	36%	0.356	43%	0.428	S	S	.	.			trans	-160.5	118.8	-179.1	-177.2	61.7	0	0	0	109.5	Q157 T164 P380	Q157-L161 PolarHBondContact NE2-O 2.93Å; Q157-L161 CarbonylContact O-C 3.55Å; Q157-L161 PolarHBondContact O-N 2.93Å; L161-T164 HydrophobicContact CD1-CG2 4.08Å; L161-T164 HydrophobicContact CD2-CG2 3.64Å; L161-T164 HydrophobicContact CG-CG2 4.03Å; L161-P380 HydrophobicContact CD2-CG 4.39Å; L161-P380 HydrophobicContact CG-CG 4.3Å; L161-P380 WeakPolarHBondContact O-CB 3.21Å
162	A	98.2	Very high	98.3	Very high	47 Å²	47	75.5 Å²	75.5	39%	0.388	41%	0.413	S	S	.	.			trans	-94.7	-43.7	-175	0	0	0	0	0	114	N379 P380 V381	A162-N379 PolarHBondContact O-OD1 3.46Å; A162-P380 WeakPolarHBondContact O-CD 3.42Å; A162-V381 HydrophobicContact CB-CG2 4.07Å
163	L	98.6	Very high	98.3	Very high	66 Å²	66	74.3 Å²	74.3	35%	0.346	40%	0.403	S	S	.	.			trans	-151	133.7	-171.6	-175.2	66.4	0	0	0	111.3	T375 Y376 N379	L163-T375 WeakPolarHBondContact CD1-O 3.29Å; L163-T375 HydrophobicContact CD2-CG2 4.5Å; L163-Y376 HydrophobicContact CD1-CD1 3.92Å; L163-Y376 HydrophobicContact CD1-CE1 4.37Å; L163-Y376 HydrophobicContact CD2-CD1 4.01Å; L163-Y376 HydrophobicContact CD2-CE1 3.62Å; L163-N379 HydrophobicContact CD1-CB 3.65Å
164	T	98	Very high	98.3	Very high	28 Å²	28	75.2 Å²	75.2	17%	0.172	41%	0.414	C	S	.	.			trans	-121.9	-3.1	176.6	55.3	0	0	0	0	113.1	L161 F168 N170	L161-T164 HydrophobicContact CD1-CG2 4.08Å; L161-T164 HydrophobicContact CD2-CG2 3.64Å; L161-T164 HydrophobicContact CG-CG2 4.03Å; T164-F168 WeakPolarHBondContact O-CD2 3.36Å; T164-N170 HydrophobicContact CG2-CB 4.19Å
165	S	96.3	Very high	98.3	Very high	40 Å²	40	75 Å²	75	28%	0.28	42%	0.419	S	S	.	.			trans	56.9	-175.6	-154.5	83.2	0	0	0	0	112.5	A167	S165-A167 WeakPolarHBondContact OG-CB 3.33Å; S165-A167 PolarHBondContact OG-N 3.02Å
166	R	96.8	Very high	98.3	Very high	126 Å²	126	71.4 Å²	71.4	48%	0.475	40%	0.397	S	S	.	.	S	Bend	trans	-90.4	-0	171.2	-65.3	-66.1	-63.2	-87.3	5.2	113.7	F168 G377	R166-F168 VanDerWaalsContact C-N 3.32Å; R166-G377 WeakPolarHBondContact CD-O 3.18Å
167	A	97.2	Very high	98.3	Very high	79 Å²	79	67.5 Å²	67.5	65%	0.653	38%	0.381	S	S	*	.	S	Bend	trans	-74.2	-24.5	176.3	0	0	0	0	0	112.7	S165	S165-A167 WeakPolarHBondContact OG-CB 3.33Å; S165-A167 PolarHBondContact OG-N 3.02Å
168	F	98.3	Very high	98.3	Very high	150 Å²	150	72.5 Å²	72.5	66%	0.658	40%	0.404	S	S	*	.	S	Bend	trans	-119.6	144.3	175.4	-51.9	-64.4	0	0	0	109.6	T164 R166	T164-F168 WeakPolarHBondContact O-CD2 3.36Å; R166-F168 VanDerWaalsContact C-N 3.32Å
169	Y	98.4	Very high	98.3	Very high	233 Å²	233	73.1 Å²	73.1	91%	0.914	40%	0.396	S	S	*	.			trans	-66.7	149.6	166	-70.2	-77.7	0	0	0	110.2
170	N	98.5	Very high	98.4	Very high	21 Å²	21	68.3 Å²	68.3	11%	0.112	36%	0.363	C	S	.	.			trans	-125.7	161	162.7	66.9	78.9	0	0	0	108.2	T164 V172 L173 P380	T164-N170 HydrophobicContact CG2-CB 4.19Å; N170-V172 VanDerWaalsContact C-N 3.27Å; N170-V172 PolarHBondContact O-N 2.89Å; N170-V172 PolarHBondContact OD1-N 2.91Å; N170-V172 VanDerWaalsContact OD1-N 3.09Å; N170-L173 WeakPolarHBondContact OD1-CB 3.49Å; N170-L173 PolarHBondContact OD1-N 2.98Å; N170-P380 HydrophobicContact CB-CG 3.85Å
171	D	98.2	Very high	98.4	Very high	123 Å²	123	63.9 Å²	63.9	66%	0.658	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-5.7	-174.5	65.2	-31.2	0	0	0	114
172	V	98.7	Very high	98.4	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-38	-176	-174.3	0	0	0	0	112.4	N170 G174 A175 Y176 P380 C383 R384	N170-V172 VanDerWaalsContact C-N 3.27Å; N170-V172 PolarHBondContact O-N 2.89Å; N170-V172 PolarHBondContact OD1-N 2.91Å; N170-V172 VanDerWaalsContact OD1-N 3.09Å; V172-G174 PolarHBondContact O-N 3.37Å; V172-A175 PolarHBondContact O-N 2.74Å; V172-A175 VanDerWaalsContact O-N 3.15Å; V172-Y176 PolarHBondContact O-N 2.84Å; V172-P380 HydrophobicContact CB-CB 4.15Å; V172-P380 HydrophobicContact CG2-CB 4.04Å; V172-C383 HydrophobicContact CB-CB 4.42Å; V172-C383 HydrophobicContact CG1-CB 3.51Å; V172-R384 HydrophobicContact CG1-CG 3.67Å; V172-R384 HydrophobicContact CG2-CG 4.34Å
173	L	98.8	Very high	98.4	Very high	15 Å²	15	65.7 Å²	65.7	8%	0.079	34%	0.338	C	S	.	.	H	α-helix	trans	-57.5	-50.3	-173.3	174.6	57.5	0	0	0	111.4	N170 A175 Y176 E177 P191	N170-L173 WeakPolarHBondContact OD1-CB 3.49Å; N170-L173 PolarHBondContact OD1-N 2.98Å; L173-A175 VanDerWaalsContact C-N 3.29Å; L173-A175 PolarHBondContact O-N 2.69Å; L173-Y176 HydrophobicContact CD1-CD1 4.36Å; L173-Y176 PolarHBondContact O-N 3.2Å; L173-Y176 VanDerWaalsContact O-N 3.14Å; L173-E177 HydrophobicContact CD1-CG 3.86Å; L173-E177 WeakPolarHBondContact CD1-OE1 3.27Å; L173-E177 HydrophobicContact CG-CG 4.24Å; L173-E177 VanDerWaalsContact O-CG 3.29Å; L173-E177 WeakPolarHBondContact O-CG 3.42Å; L173-E177 PolarHBondContact O-N 3.33Å; L173-P191 HydrophobicContact CD1-CG 3.84Å
174	G	98.8	Very high	98.4	Very high	38 Å²	38	63.6 Å²	63.6	39%	0.392	33%	0.326	S	S	.	.	H	α-helix	trans	-60.1	-37.5	178.7	0	0	0	0	0	113.4	V172 E177 E178	V172-G174 PolarHBondContact O-N 3.37Å; G174-E177 PolarHBondContact O-N 3.39Å; G174-E178 WeakPolarHBondContact O-CB 3.3Å; G174-E178 PolarHBondContact O-N 3.49Å
175	A	98.8	Very high	98.4	Very high	40 Å²	40	64.5 Å²	64.5	33%	0.331	34%	0.341	S	S	.	.	H	α-helix	trans	-67.6	-37.5	176.6	0	0	0	0	0	112.2	V172 L173 Y179	V172-A175 PolarHBondContact O-N 2.74Å; V172-A175 VanDerWaalsContact O-N 3.15Å; L173-A175 VanDerWaalsContact C-N 3.29Å; L173-A175 PolarHBondContact O-N 2.69Å; A175-Y179 VanDerWaalsContact O-CB 3.27Å; A175-Y179 WeakPolarHBondContact O-CB 3.43Å; A175-Y179 PolarHBondContact O-N 3.04Å
176	Y	98.9	Very high	98.6	Very high	1 Å²	1	63 Å²	63	0%	0.004	33%	0.329	C	S	.	.	H	α-helix	trans	-67.5	-44.4	172.2	162.7	-103.1	0	0	0	111.8	V172 L173 E178 Y179 I180 P191 C383 A386 I387	V172-Y176 PolarHBondContact O-N 2.84Å; L173-Y176 HydrophobicContact CD1-CD1 4.36Å; L173-Y176 PolarHBondContact O-N 3.2Å; L173-Y176 VanDerWaalsContact O-N 3.14Å; Y176-E178 VanDerWaalsContact C-N 3.33Å; Y176-E178 PolarHBondContact O-N 3.21Å; Y176-Y179 PolarHBondContact O-N 2.96Å; Y176-I180 HydrophobicContact CE1-CG2 4.29Å; Y176-I180 HydrophobicContact CE2-CB 4.07Å; Y176-I180 HydrophobicContact CE2-CD1 3.87Å; Y176-I180 HydrophobicContact CE2-CG1 4.47Å; Y176-I180 HydrophobicContact CE2-CG2 4.24Å; Y176-I180 VanDerWaalsContact O-CG2 3.29Å; Y176-I180 WeakPolarHBondContact O-CG2 3.33Å; Y176-I180 PolarHBondContact O-N 3.02Å; Y176-I180 WeakPolarHBondContact OH-CD1 3.3Å; Y176-P191 HydrophobicContact CE1-CB 4.01Å; Y176-P191 HydrophobicContact CE1-CG 4.43Å; Y176-C383 HydrophobicContact CD1-CB 4.38Å; Y176-C383 HydrophobicContact CG-CB 3.98Å; Y176-A386 HydrophobicContact CD2-CB 4.08Å; Y176-A386 HydrophobicContact CE2-CB 3.65Å; Y176-I387 HydrophobicContact CD2-CG1 4.02Å
177	E	98.9	Very high	98.7	Very high	60 Å²	60	61 Å²	61	28%	0.28	33%	0.327	S	S	.	.	H	α-helix	trans	-57.8	-46.9	177.9	-70.2	174.4	162.4	0	0	110.6	L173 G174 T181 V189	L173-E177 HydrophobicContact CD1-CG 3.86Å; L173-E177 WeakPolarHBondContact CD1-OE1 3.27Å; L173-E177 HydrophobicContact CG-CG 4.24Å; L173-E177 VanDerWaalsContact O-CG 3.29Å; L173-E177 WeakPolarHBondContact O-CG 3.42Å; L173-E177 PolarHBondContact O-N 3.33Å; G174-E177 PolarHBondContact O-N 3.39Å; E177-T181 VanDerWaalsContact O-CB 3.3Å; E177-T181 WeakPolarHBondContact O-CB 3.37Å; E177-T181 VanDerWaalsContact O-CG2 3.24Å; E177-T181 WeakPolarHBondContact O-CG2 3.35Å; E177-T181 PolarHBondContact O-N 2.86Å; E177-T181 VanDerWaalsContact O-N 3.1Å; E177-T181 PolarHBondContact O-OG1 3.04Å; E177-V189 HydrophobicContact CB-CG1 3.87Å; E177-V189 HydrophobicContact CG-CG1 3.67Å
178	E	98.9	Very high	98.7	Very high	124 Å²	124	61.7 Å²	61.7	58%	0.579	32%	0.316	S	S	*	.	H	α-helix	trans	-60.9	-48.7	173.8	179.5	179.6	-172.9	0	0	112.2	G174 Y176 I180 T181 N182	G174-E178 WeakPolarHBondContact O-CB 3.3Å; G174-E178 PolarHBondContact O-N 3.49Å; Y176-E178 VanDerWaalsContact C-N 3.33Å; Y176-E178 PolarHBondContact O-N 3.21Å; E178-I180 PolarHBondContact O-N 3.49Å; E178-T181 WeakPolarHBondContact CA-OG1 3.11Å; E178-T181 PolarHBondContact O-OG1 3.42Å; E178-T181 VanDerWaalsContact O-OG1 3.07Å; E178-N182 WeakPolarHBondContact CG-ND2 3.27Å; E178-N182 VanDerWaalsContact O-CB 3.32Å; E178-N182 WeakPolarHBondContact O-CB 3.49Å; E178-N182 VanDerWaalsContact O-CG 3.24Å; E178-N182 PolarHBondContact O-N 3.49Å; E178-N182 PolarHBondContact O-ND2 3.3Å; E178-N182 VanDerWaalsContact O-ND2 3.16Å
179	Y	98.9	Very high	98.8	Very high	64 Å²	64	55.1 Å²	55.1	25%	0.251	29%	0.288	S	S	.	.	H	α-helix	trans	-59.3	-49.9	-177.9	-176.5	-87.4	0	0	0	112	A175 Y176 M183 I387 L390 E391	A175-Y179 VanDerWaalsContact O-CB 3.27Å; A175-Y179 WeakPolarHBondContact O-CB 3.43Å; A175-Y179 PolarHBondContact O-N 3.04Å; Y176-Y179 PolarHBondContact O-N 2.96Å; Y179-M183 HydrophobicContact CE1-CE 3.64Å; Y179-M183 HydrophobicContact CE1-SD 4.21Å; Y179-M183 WeakPolarHBondContact O-CB 3.46Å; Y179-M183 PolarHBondContact O-N 3.18Å; Y179-M183 WeakPolarHBondContact OH-CE 3.45Å; Y179-I387 HydrophobicContact CD1-CG1 4.45Å; Y179-I387 HydrophobicContact CD2-CG2 4.39Å; Y179-I387 HydrophobicContact CE2-CG2 4.44Å; Y179-I387 HydrophobicContact CG-CG1 4.41Å; Y179-I387 HydrophobicContact CG-CG2 4.47Å; Y179-L390 HydrophobicContact CD1-CD1 4.04Å; Y179-L390 HydrophobicContact CE1-CB 3.65Å; Y179-L390 HydrophobicContact CE1-CD1 3.84Å; Y179-L390 HydrophobicContact CE1-CG 4.41Å; Y179-E391 HydrophobicContact CE2-CG 4.32Å; Y179-E391 WeakPolarHBondContact OH-CG 3.27Å
180	I	98.9	Very high	98.8	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-73.5	-36.6	-174.4	-160.7	175	0	0	0	112.1	Y176 E178 M183 F184 V189 L343 L347 A356 L358 L390	Y176-I180 HydrophobicContact CE1-CG2 4.29Å; Y176-I180 HydrophobicContact CE2-CB 4.07Å; Y176-I180 HydrophobicContact CE2-CD1 3.87Å; Y176-I180 HydrophobicContact CE2-CG1 4.47Å; Y176-I180 HydrophobicContact CE2-CG2 4.24Å; Y176-I180 VanDerWaalsContact O-CG2 3.29Å; Y176-I180 WeakPolarHBondContact O-CG2 3.33Å; Y176-I180 PolarHBondContact O-N 3.02Å; Y176-I180 WeakPolarHBondContact OH-CD1 3.3Å; E178-I180 PolarHBondContact O-N 3.49Å; I180-M183 PolarHBondContact O-N 2.97Å; I180-F184 HydrophobicContact CD1-CD2 4.44Å; I180-F184 HydrophobicContact CD1-CE2 4.28Å; I180-F184 HydrophobicContact CG1-CD2 3.6Å; I180-F184 HydrophobicContact CG1-CE2 3.69Å; I180-F184 VanDerWaalsContact O-CD2 3.32Å; I180-F184 WeakPolarHBondContact O-CD2 3.31Å; I180-F184 PolarHBondContact O-N 3.3Å; I180-F184 VanDerWaalsContact O-N 3.12Å; I180-V189 HydrophobicContact CG2-CB 3.87Å; I180-V189 HydrophobicContact CG2-CG1 3.59Å; I180-V189 HydrophobicContact CG2-CG2 4Å; I180-L343 HydrophobicContact CD1-CD1 4.33Å; I180-L347 HydrophobicContact CD1-CD1 4Å; I180-A356 HydrophobicContact CD1-CB 4.16Å; I180-L358 HydrophobicContact CD1-CD1 4.32Å; I180-L358 HydrophobicContact CG1-CD2 4.17Å; I180-L358 HydrophobicContact CG2-CD2 4.43Å; I180-L390 HydrophobicContact CD1-CD1 4.35Å; I180-L390 HydrophobicContact CG1-CD1 4.15Å
181	T	98.9	Very high	98.8	Very high	18 Å²	18	44.2 Å²	44.2	11%	0.11	25%	0.246	C	C	.	.	H	α-helix	trans	-65.7	-43.5	176.4	47.7	0	0	0	0	111.7	E177 E178 M183 G185 Y186 V189	E177-T181 VanDerWaalsContact O-CB 3.3Å; E177-T181 WeakPolarHBondContact O-CB 3.37Å; E177-T181 VanDerWaalsContact O-CG2 3.24Å; E177-T181 WeakPolarHBondContact O-CG2 3.35Å; E177-T181 PolarHBondContact O-N 2.86Å; E177-T181 VanDerWaalsContact O-N 3.1Å; E177-T181 PolarHBondContact O-OG1 3.04Å; E178-T181 WeakPolarHBondContact CA-OG1 3.11Å; E178-T181 PolarHBondContact O-OG1 3.42Å; E178-T181 VanDerWaalsContact O-OG1 3.07Å; T181-M183 PolarHBondContact O-N 3.3Å; T181-G185 WeakPolarHBondContact O-CA 3.39Å; T181-G185 PolarHBondContact O-N 2.91Å; T181-Y186 WeakPolarHBondContact CB-O 3.35Å; T181-Y186 WeakPolarHBondContact CG2-O 3.45Å; T181-Y186 PolarHBondContact O-N 3.19Å; T181-V189 HydrophobicContact CG2-CB 4.24Å; T181-V189 HydrophobicContact CG2-CG1 4.22Å
182	N	98.8	Very high	98.8	Very high	119 Å²	119	38.8 Å²	38.8	64%	0.636	22%	0.217	S	C	*	.	H	α-helix	trans	-63.1	-41	174.6	-73.6	-26.5	0	0	0	112.3	E178	E178-N182 WeakPolarHBondContact CG-ND2 3.27Å; E178-N182 VanDerWaalsContact O-CB 3.32Å; E178-N182 WeakPolarHBondContact O-CB 3.49Å; E178-N182 VanDerWaalsContact O-CG 3.24Å; E178-N182 PolarHBondContact O-N 3.49Å; E178-N182 PolarHBondContact O-ND2 3.3Å; E178-N182 VanDerWaalsContact O-ND2 3.16Å
183	M	98.7	Very high	98.8	Very high	34 Å²	34	39.9 Å²	39.9	17%	0.167	22%	0.222	C	C	.	.	H	α-helix	trans	-64.3	-42.7	-178.9	175.6	171.8	-81.8	0	0	112.9	Y179 I180 T181 L390 M393 E394	Y179-M183 HydrophobicContact CE1-CE 3.64Å; Y179-M183 HydrophobicContact CE1-SD 4.21Å; Y179-M183 WeakPolarHBondContact O-CB 3.46Å; Y179-M183 PolarHBondContact O-N 3.18Å; Y179-M183 WeakPolarHBondContact OH-CE 3.45Å; I180-M183 PolarHBondContact O-N 2.97Å; T181-M183 PolarHBondContact O-N 3.3Å; M183-L390 HydrophobicContact CE-CB 4.2Å; M183-L390 HydrophobicContact SD-CB 4.09Å; M183-L390 HydrophobicContact SD-CD1 4.2Å; M183-L390 HydrophobicContact SD-CD2 3.98Å; M183-L390 HydrophobicContact SD-CG 4.32Å; M183-M393 HydrophobicContact SD-CE 4.13Å; M183-E394 HydrophobicContact CE-CG 3.64Å
184	F	98.8	Very high	98.8	Very high	23 Å²	23	42 Å²	42	10%	0.101	24%	0.236	C	C	.	.	H	α-helix	trans	-101.8	-3.4	-175.2	-64.9	-72.9	0	0	0	114	I180 Y186 L322 L329 L343 L358 L390	I180-F184 HydrophobicContact CD1-CD2 4.44Å; I180-F184 HydrophobicContact CD1-CE2 4.28Å; I180-F184 HydrophobicContact CG1-CD2 3.6Å; I180-F184 HydrophobicContact CG1-CE2 3.69Å; I180-F184 VanDerWaalsContact O-CD2 3.32Å; I180-F184 WeakPolarHBondContact O-CD2 3.31Å; I180-F184 PolarHBondContact O-N 3.3Å; I180-F184 VanDerWaalsContact O-N 3.12Å; F184-Y186 HydrophobicContact CB-CD2 3.92Å; F184-Y186 HydrophobicContact CB-CE2 4.27Å; F184-Y186 WeakPolarHBondContact O-CD2 3.26Å; F184-Y186 WeakPolarHBondContact O-CE2 3.31Å; F184-L322 HydrophobicContact CE1-CD2 4.39Å; F184-L322 HydrophobicContact CE2-CD2 4.49Å; F184-L322 HydrophobicContact CZ-CD2 3.65Å; F184-L329 HydrophobicContact CD1-CD1 3.82Å; F184-L329 HydrophobicContact CD1-CD2 4.03Å; F184-L329 HydrophobicContact CD1-CG 3.9Å; F184-L329 HydrophobicContact CE1-CD1 4.32Å; F184-L329 HydrophobicContact CE1-CD2 3.69Å; F184-L329 HydrophobicContact CE1-CG 3.91Å; F184-L343 HydrophobicContact CD2-CD1 4.05Å; F184-L343 HydrophobicContact CE1-CD1 4.39Å; F184-L343 HydrophobicContact CE2-CD1 3.71Å; F184-L343 HydrophobicContact CZ-CD1 3.9Å; F184-L358 HydrophobicContact CB-CD2 4.07Å; F184-L358 HydrophobicContact CD2-CD2 4.28Å; F184-L390 HydrophobicContact CE2-CD2 4.25Å; F184-L390 HydrophobicContact CZ-CD2 4.19Å
185	G	98.5	Very high	98.8	Very high	46 Å²	46	41.1 Å²	41.1	47%	0.474	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.9	50.3	175.4	0	0	0	0	0	113.4	T181 R337	T181-G185 WeakPolarHBondContact O-CA 3.39Å; T181-G185 PolarHBondContact O-N 2.91Å; G185-R337 PolarHBondContact O-NE 3.12Å; G185-R337 VanDerWaalsContact O-NE 3.16Å; G185-R337 PolarHBondContact O-NH2 2.92Å
186	Y	98.9	Very high	98.8	Very high	10 Å²	10	40.6 Å²	40.6	4%	0.039	22%	0.22	C	C	.	.			trans	-125.4	151.6	174.3	-74.1	-84.3	0	0	0	110.6	T181 F184 K188 P338 V341 L358	T181-Y186 WeakPolarHBondContact CB-O 3.35Å; T181-Y186 WeakPolarHBondContact CG2-O 3.45Å; T181-Y186 PolarHBondContact O-N 3.19Å; F184-Y186 HydrophobicContact CB-CD2 3.92Å; F184-Y186 HydrophobicContact CB-CE2 4.27Å; F184-Y186 WeakPolarHBondContact O-CD2 3.26Å; F184-Y186 WeakPolarHBondContact O-CE2 3.31Å; Y186-K188 PolarHBondContact O-N 2.83Å; Y186-P338 WeakPolarHBondContact CE1-O 3.4Å; Y186-P338 WeakPolarHBondContact OH-CD 3.41Å; Y186-P338 WeakPolarHBondContact OH-CG 3.38Å; Y186-P338 PolarHBondContact OH-O 3.48Å; Y186-V341 HydrophobicContact CD2-CG1 4.21Å; Y186-V341 HydrophobicContact CE2-CG1 3.52Å; Y186-L358 HydrophobicContact CD1-CB 4.31Å; Y186-L358 HydrophobicContact CD2-CB 3.71Å; Y186-L358 HydrophobicContact CD2-CD2 4.04Å; Y186-L358 HydrophobicContact CE2-CB 4.32Å; Y186-L358 HydrophobicContact CG-CB 3.71Å; Y186-L358 HydrophobicContact CG-CD2 4.44Å
187	D	98.9	Very high	98.8	Very high	82 Å²	82	43.2 Å²	43.2	44%	0.439	23%	0.232	S	C	.	.	S	Bend	trans	-68.4	-33.7	179.7	-67.4	-26.8	0	0	0	113.7	D360 N361	D187-D360 PolarHBondContact N-OD1 2.75Å; D187-N361 HydrophobicContact CB-CB 4.38Å; D187-N361 WeakPolarHBondContact CB-ND2 3.3Å; D187-N361 WeakPolarHBondContact OD2-CB 3.03Å; D187-N361 VanDerWaalsContact OD2-CG 3.29Å; D187-N361 PolarHBondContact OD2-N 2.74Å; D187-N361 PolarHBondContact OD2-ND2 2.92Å
188	K	98.9	Very high	98.8	Very high	94 Å²	94	40.3 Å²	40.3	41%	0.409	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	155.2	-171.7	-65.3	-68.6	178.7	-172.5	0	112.5	Y186 L358 S359 N361 M364	Y186-K188 PolarHBondContact O-N 2.83Å; K188-L358 WeakPolarHBondContact O-CA 3.48Å; K188-S359 PolarHBondContact N-O 3.16Å; K188-S359 VanDerWaalsContact N-O 3.13Å; K188-S359 PolarHBondContact O-N 3.27Å; K188-S359 VanDerWaalsContact O-N 3.16Å; K188-N361 WeakPolarHBondContact CE-OD1 3.38Å; K188-N361 WeakPolarHBondContact CG-OD1 3.23Å; K188-M364 HydrophobicContact CB-CB 3.8Å; K188-M364 HydrophobicContact CB-CE 4.3Å; K188-M364 HydrophobicContact CB-CG 3.57Å; K188-M364 HydrophobicContact CG-CB 4.14Å; K188-M364 HydrophobicContact CG-CG 4.13Å
189	V	98.9	Very high	98.8	Very high	13 Å²	13	34.4 Å²	34.4	8%	0.079	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	145.6	168.5	63.5	0	0	0	0	110.2	E177 I180 T181 A356 V357 L358	E177-V189 HydrophobicContact CB-CG1 3.87Å; E177-V189 HydrophobicContact CG-CG1 3.67Å; I180-V189 HydrophobicContact CG2-CB 3.87Å; I180-V189 HydrophobicContact CG2-CG1 3.59Å; I180-V189 HydrophobicContact CG2-CG2 4Å; T181-V189 HydrophobicContact CG2-CB 4.24Å; T181-V189 HydrophobicContact CG2-CG1 4.22Å; V189-A356 HydrophobicContact CG2-CB 3.67Å; V189-V357 CarbonylContact C-O 3.6Å; V189-V357 WeakPolarHBondContact CA-O 3.43Å; V189-L358 HydrophobicContact CB-CD2 4.37Å; V189-L358 HydrophobicContact CB-CG 4.03Å; V189-L358 HydrophobicContact CG2-CD1 4.29Å; V189-L358 HydrophobicContact CG2-CG 3.9Å
190	L	98.8	Very high	98.7	Very high	22 Å²	22	33.8 Å²	33.8	12%	0.115	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	104.5	167.1	-164.6	162.4	0	0	0	108.6	M192 T201 V357 M364	L190-M192 HydrophobicContact CD2-CG 3.67Å; L190-M192 HydrophobicContact CD2-SD 3.52Å; L190-M192 VanDerWaalsContact CD2-SD 3.52Å; L190-T201 HydrophobicContact CD1-CG2 3.87Å; L190-T201 HydrophobicContact CD2-CG2 4Å; L190-T201 HydrophobicContact CG-CG2 4.34Å; L190-V357 PolarHBondContact N-O 3.21Å; L190-V357 PolarHBondContact O-N 3.29Å; L190-M364 HydrophobicContact CB-CE 4.17Å; L190-M364 HydrophobicContact CB-SD 3.91Å; L190-M364 HydrophobicContact CD1-SD 4.35Å
191	P	98.6	Very high	98.7	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.013	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	136.1	178.9	27.1	-30.8	0	0	0	112.6	L173 Y176 S355 G377	L173-P191 HydrophobicContact CD1-CG 3.84Å; Y176-P191 HydrophobicContact CE1-CB 4.01Å; Y176-P191 HydrophobicContact CE1-CG 4.43Å; P191-S355 WeakPolarHBondContact CA-O 3.4Å; P191-G377 CarbonylContact O-C 3.56Å; P191-G377 WeakPolarHBondContact O-CA 3.28Å
192	M	98.6	Very high	98.7	Very high	10 Å²	10	32.9 Å²	32.9	5%	0.049	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	-167.1	175.3	-63.1	-60.4	-77.4	0	0	109.1	L190 E197 S355 H372	L190-M192 HydrophobicContact CD2-CG 3.67Å; L190-M192 HydrophobicContact CD2-SD 3.52Å; L190-M192 VanDerWaalsContact CD2-SD 3.52Å; M192-E197 HydrophobicContact CB-CB 3.86Å; M192-E197 HydrophobicContact CE-CB 3.82Å; M192-E197 HydrophobicContact CE-CG 4.14Å; M192-E197 HydrophobicContact CG-CB 4.33Å; M192-S355 CarbonylContact C-O 3.6Å; M192-S355 VanDerWaalsContact C-OG 3.23Å; M192-S355 VanDerWaalsContact CB-OG 3.27Å; M192-S355 WeakPolarHBondContact CB-OG 3.36Å; M192-S355 PolarHBondContact N-O 3.38Å; M192-S355 PolarHBondContact O-N 3.1Å; M192-S355 VanDerWaalsContact O-O 3.1Å; M192-H372 WeakPolarHBondContact CE-NE2 3.32Å
193	N	98.7	Very high	98.7	Very high	22 Å²	22	27.5 Å²	27.5	12%	0.118	16%	0.156	C	C	.	.	S	Bend	trans	-110.8	-41.7	-172.8	-37.6	-78.2	0	0	0	112.2	E197 P353 V354 S355 S374 Y376 G377	N193-E197 VanDerWaalsContact CA-OE2 3.3Å; N193-E197 WeakPolarHBondContact CA-OE2 3.34Å; N193-E197 WeakPolarHBondContact CB-OE2 3.26Å; N193-E197 PolarHBondContact N-OE2 3Å; N193-E197 VanDerWaalsContact ND2-CD 3.34Å; N193-E197 PolarHBondContact ND2-OE1 3.43Å; N193-E197 PolarHBondContact ND2-OE2 2.75Å; N193-P353 CarbonylContact O-C 3.47Å; N193-P353 WeakPolarHBondContact O-CB 3.25Å; N193-V354 CarbonylContact O-C 3.5Å; N193-V354 WeakPolarHBondContact O-CA 3.33Å; N193-V354 PolarHBondContact O-N 2.84Å; N193-S355 PolarHBondContact N-OG 3.06Å; N193-S374 PolarHBondContact ND2-OG 3.08Å; N193-Y376 WeakPolarHBondContact OD1-CB 3.5Å; N193-Y376 PolarHBondContact OD1-O 2.75Å; N193-G377 PolarHBondContact OD1-N 3.05Å
194	T	98.8	Very high	98.7	Very high	60 Å²	60	30.2 Å²	30.2	37%	0.368	17%	0.167	S	C	.	.	S	Bend	trans	-118.6	157	-176.2	64.8	0	0	0	0	111.9	V196 E197 G198 S355	T194-V196 PolarHBondContact O-N 2.55Å; T194-V196 WeakPolarHBondContact OG1-CG1 3.31Å; T194-E197 PolarHBondContact N-OE2 3.03Å; T194-E197 PolarHBondContact O-N 3.34Å; T194-E197 WeakPolarHBondContact OG1-CG 3.39Å; T194-E197 PolarHBondContact OG1-N 3.01Å; T194-E197 PolarHBondContact OG1-OE2 2.94Å; T194-G198 PolarHBondContact O-N 3.36Å; T194-G198 VanDerWaalsContact O-N 3.15Å; T194-S355 VanDerWaalsContact C-OG 3.28Å; T194-S355 PolarHBondContact N-OG 3.26Å; T194-S355 WeakPolarHBondContact O-CB 3.43Å; T194-S355 PolarHBondContact O-OG 3.06Å
195	G	98.4	Very high	98.8	Very high	20 Å²	20	29.1 Å²	29.1	21%	0.206	16%	0.162	C	C	.	.	H	α-helix	trans	-55.4	-41.5	175.5	0	0	0	0	0	112.4	E197 G198 G199	G195-E197 PolarHBondContact O-N 2.83Å; G195-G198 CarbonylContact O-C 3.54Å; G195-G198 WeakPolarHBondContact O-CA 3.27Å; G195-G198 PolarHBondContact O-N 3.02Å; G195-G199 PolarHBondContact O-N 3.32Å
196	V	98.6	Very high	98.8	Very high	29 Å²	29	26.9 Å²	26.9	18%	0.176	14%	0.14	C	C	.	.	H	α-helix	trans	-65.9	-37.1	178.9	68	0	0	0	0	113	T194 G198 G199 E200 W231 T234 A237	T194-V196 PolarHBondContact O-N 2.55Å; T194-V196 WeakPolarHBondContact OG1-CG1 3.31Å; V196-G198 PolarHBondContact O-N 2.65Å; V196-G199 PolarHBondContact O-N 3.2Å; V196-E200 HydrophobicContact CG2-CG 4.48Å; V196-E200 VanDerWaalsContact O-CG 3.28Å; V196-E200 WeakPolarHBondContact O-CG 3.29Å; V196-E200 PolarHBondContact O-N 2.85Å; V196-W231 VanDerWaalsContact CA-O 3.32Å; V196-W231 WeakPolarHBondContact CA-O 3.35Å; V196-W231 WeakPolarHBondContact CB-O 3.41Å; V196-W231 HydrophobicContact CG2-CE3 4.2Å; V196-W231 HydrophobicContact CG2-CZ3 4.26Å; V196-T234 HydrophobicContact CG1-CG2 4.21Å; V196-T234 HydrophobicContact CG2-CG2 3.53Å; V196-T234 WeakPolarHBondContact CG2-OG1 3.34Å; V196-A237 HydrophobicContact CG2-CB 4.17Å
197	E	98.9	Very high	98.8	Very high	55 Å²	55	28.9 Å²	28.9	26%	0.257	15%	0.147	S	C	.	.	H	α-helix	trans	-63.1	-32.8	171.1	-75.3	175.1	136	0	0	112	M192 N193 T194 G195 T201	M192-E197 HydrophobicContact CB-CB 3.86Å; M192-E197 HydrophobicContact CE-CB 3.82Å; M192-E197 HydrophobicContact CE-CG 4.14Å; M192-E197 HydrophobicContact CG-CB 4.33Å; N193-E197 VanDerWaalsContact CA-OE2 3.3Å; N193-E197 WeakPolarHBondContact CA-OE2 3.34Å; N193-E197 WeakPolarHBondContact CB-OE2 3.26Å; N193-E197 PolarHBondContact N-OE2 3Å; N193-E197 VanDerWaalsContact ND2-CD 3.34Å; N193-E197 PolarHBondContact ND2-OE1 3.43Å; N193-E197 PolarHBondContact ND2-OE2 2.75Å; T194-E197 PolarHBondContact N-OE2 3.03Å; T194-E197 PolarHBondContact O-N 3.34Å; T194-E197 WeakPolarHBondContact OG1-CG 3.39Å; T194-E197 PolarHBondContact OG1-N 3.01Å; T194-E197 PolarHBondContact OG1-OE2 2.94Å; G195-E197 PolarHBondContact O-N 2.83Å; E197-T201 VanDerWaalsContact O-CB 3.26Å; E197-T201 WeakPolarHBondContact O-CB 3.32Å; E197-T201 PolarHBondContact O-N 3.04Å; E197-T201 PolarHBondContact O-OG1 3.37Å
198	G	98.7	Very high	98.8	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-62.7	-48.6	171.2	0	0	0	0	0	112	T194 G195 V196 T201 A202 V357	T194-G198 PolarHBondContact O-N 3.36Å; T194-G198 VanDerWaalsContact O-N 3.15Å; G195-G198 CarbonylContact O-C 3.54Å; G195-G198 WeakPolarHBondContact O-CA 3.27Å; G195-G198 PolarHBondContact O-N 3.02Å; V196-G198 PolarHBondContact O-N 2.65Å; G198-T201 WeakPolarHBondContact O-CB 3.36Å; G198-T201 PolarHBondContact O-N 3.27Å; G198-A202 WeakPolarHBondContact O-CB 3.45Å; G198-A202 PolarHBondContact O-N 3.28Å; G198-V357 VanDerWaalsContact O-CG2 3.23Å; G198-V357 WeakPolarHBondContact O-CG2 3.27Å
199	G	98.7	Very high	98.8	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61.3	-43.6	175	0	0	0	0	0	113.6	G195 V196 T201 A202 C203 W231	G195-G199 PolarHBondContact O-N 3.32Å; V196-G199 PolarHBondContact O-N 3.2Å; G199-T201 VanDerWaalsContact C-N 3.3Å; G199-T201 PolarHBondContact O-N 2.93Å; G199-A202 PolarHBondContact O-N 3.25Å; G199-C203 WeakPolarHBondContact O-CB 3.38Å; G199-C203 PolarHBondContact O-N 3.47Å; G199-C203 PolarHBondContact O-SG 2.96Å; G199-W231 VanDerWaalsContact C-CZ3 3.47Å
200	E	98.8	Very high	98.8	Very high	50 Å²	50	22.7 Å²	22.7	23%	0.234	12%	0.115	C	C	.	.	H	α-helix	trans	-60.7	-42	175.1	-70.9	-73.9	-173.1	0	0	111	V196 C203 K204 W231 T234 A236	V196-E200 HydrophobicContact CG2-CG 4.48Å; V196-E200 VanDerWaalsContact O-CG 3.28Å; V196-E200 WeakPolarHBondContact O-CG 3.29Å; V196-E200 PolarHBondContact O-N 2.85Å; E200-C203 PolarHBondContact O-N 2.92Å; E200-K204 WeakPolarHBondContact O-CG 3.48Å; E200-K204 PolarHBondContact O-N 3.15Å; E200-W231 HydrophobicContact CG-CZ3 4.05Å; E200-T234 WeakPolarHBondContact OE1-CB 3.4Å; E200-T234 PolarHBondContact OE1-OG1 3.36Å; E200-A236 VanDerWaalsContact OE1-CB 3.23Å; E200-A236 WeakPolarHBondContact OE1-CB 3.49Å
201	T	98.9	Very high	98.7	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-64	-46.3	177	-61.5	0	0	0	0	111.4	L190 E197 G198 G199 C203 K204 L205 V357 H372	L190-T201 HydrophobicContact CD1-CG2 3.87Å; L190-T201 HydrophobicContact CD2-CG2 4Å; L190-T201 HydrophobicContact CG-CG2 4.34Å; E197-T201 VanDerWaalsContact O-CB 3.26Å; E197-T201 WeakPolarHBondContact O-CB 3.32Å; E197-T201 PolarHBondContact O-N 3.04Å; E197-T201 PolarHBondContact O-OG1 3.37Å; G198-T201 WeakPolarHBondContact O-CB 3.36Å; G198-T201 PolarHBondContact O-N 3.27Å; G199-T201 VanDerWaalsContact C-N 3.3Å; G199-T201 PolarHBondContact O-N 2.93Å; T201-C203 PolarHBondContact O-N 2.96Å; T201-K204 PolarHBondContact O-N 3.22Å; T201-L205 HydrophobicContact CG2-CD1 4.05Å; T201-L205 WeakPolarHBondContact O-CB 3.5Å; T201-L205 WeakPolarHBondContact O-CG 3.34Å; T201-L205 PolarHBondContact O-N 2.99Å; T201-V357 HydrophobicContact CG2-CB 4.28Å; T201-V357 HydrophobicContact CG2-CG2 3.88Å; T201-H372 PolarHBondContact OG1-CE1 3.45Å; T201-H372 PolarHBondContact OG1-NE2 2.89Å
202	A	98.9	Very high	98.7	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62.6	-41.8	177.4	0	0	0	0	0	111.7	G198 G199 K204 L205 A206 I314 L340 I342 V357	G198-A202 WeakPolarHBondContact O-CB 3.45Å; G198-A202 PolarHBondContact O-N 3.28Å; G199-A202 PolarHBondContact O-N 3.25Å; A202-K204 PolarHBondContact O-N 2.89Å; A202-L205 PolarHBondContact O-N 2.89Å; A202-A206 WeakPolarHBondContact O-CB 2.98Å; A202-A206 PolarHBondContact O-N 3.02Å; A202-I314 HydrophobicContact CB-CD1 4.14Å; A202-I314 HydrophobicContact CB-CG2 3.86Å; A202-L340 HydrophobicContact CB-CD2 4.44Å; A202-I342 HydrophobicContact CB-CD1 3.81Å; A202-I342 HydrophobicContact CB-CG1 3.99Å; A202-V357 HydrophobicContact CB-CG1 4.28Å
203	C	98.8	Very high	98.7	Very high	5 Å²	5	31.8 Å²	31.8	3%	0.034	17%	0.169	C	C	.	.	H	α-helix	trans	-61.2	-43	174.3	-71.7	0	0	0	0	112.2	G199 E200 T201 R207 I223	G199-C203 WeakPolarHBondContact O-CB 3.38Å; G199-C203 PolarHBondContact O-N 3.47Å; G199-C203 PolarHBondContact O-SG 2.96Å; E200-C203 PolarHBondContact O-N 2.92Å; T201-C203 PolarHBondContact O-N 2.96Å; C203-R207 WeakPolarHBondContact O-CG 3.4Å; C203-R207 PolarHBondContact O-N 3.28Å; C203-I223 HydrophobicContact CB-CD1 3.78Å
204	K	98.8	Very high	98.7	Very high	91 Å²	91	32.5 Å²	32.5	40%	0.396	17%	0.171	S	C	.	.	H	α-helix	trans	-64.4	-44.4	175.9	-77	-178.1	65.6	178.9	0	112	E200 T201 A202 R207 K208 E371 H372	E200-K204 WeakPolarHBondContact O-CG 3.48Å; E200-K204 PolarHBondContact O-N 3.15Å; T201-K204 PolarHBondContact O-N 3.22Å; A202-K204 PolarHBondContact O-N 2.89Å; K204-R207 PolarHBondContact O-N 2.86Å; K204-K208 VanDerWaalsContact O-CB 3.3Å; K204-K208 WeakPolarHBondContact O-CB 3.44Å; K204-K208 PolarHBondContact O-N 3.28Å; K204-E371 PolarHBondContact NZ-O 3.3Å; K204-H372 PolarHBondContact NZ-ND1 3.45Å; K204-H372 VanDerWaalsContact NZ-ND1 3.2Å
205	L	98.9	Very high	98.7	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-59	-49.6	176	-80.9	166.1	0	0	0	110.9	T201 A202 R207 K208 W209 L340 V357 V363 M364 I367	T201-L205 HydrophobicContact CG2-CD1 4.05Å; T201-L205 WeakPolarHBondContact O-CB 3.5Å; T201-L205 WeakPolarHBondContact O-CG 3.34Å; T201-L205 PolarHBondContact O-N 2.99Å; A202-L205 PolarHBondContact O-N 2.89Å; L205-R207 PolarHBondContact O-N 3.41Å; L205-K208 PolarHBondContact O-N 2.96Å; L205-W209 VanDerWaalsContact O-CB 3.31Å; L205-W209 WeakPolarHBondContact O-CB 3.44Å; L205-W209 PolarHBondContact O-N 3.19Å; L205-L340 HydrophobicContact CB-CD2 3.95Å; L205-L340 HydrophobicContact CD1-CD2 3.84Å; L205-V357 HydrophobicContact CD1-CG1 3.97Å; L205-V363 HydrophobicContact CB-CG1 4.21Å; L205-M364 HydrophobicContact CD1-CE 4.3Å; L205-M364 HydrophobicContact CD1-SD 3.8Å; L205-M364 HydrophobicContact CD2-SD 4.09Å; L205-I367 HydrophobicContact CD2-CB 4.4Å; L205-I367 HydrophobicContact CD2-CD1 3.47Å; L205-I367 VanDerWaalsContact CD2-CD1 3.47Å; L205-I367 HydrophobicContact CD2-CG1 3.74Å; L205-I367 HydrophobicContact CG-CD1 3.68Å; L205-I367 HydrophobicContact CG-CG1 4.43Å
206	A	98.9	Very high	98.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.3	-46.3	179.3	0	0	0	0	0	112.7	A202 A210 I223 A278 A279 L312 I314	A202-A206 WeakPolarHBondContact O-CB 2.98Å; A202-A206 PolarHBondContact O-N 3.02Å; A206-A210 VanDerWaalsContact O-CB 3.31Å; A206-A210 WeakPolarHBondContact O-CB 3.13Å; A206-A210 PolarHBondContact O-N 3.02Å; A206-I223 HydrophobicContact CB-CD1 4.25Å; A206-A278 HydrophobicContact CB-CB 4.44Å; A206-A279 HydrophobicContact CB-CB 3.66Å; A206-L312 HydrophobicContact CB-CD1 4.19Å; A206-I314 HydrophobicContact CB-CD1 4.08Å
207	R	98.8	Very high	98.7	Very high	51 Å²	51	33.9 Å²	33.9	19%	0.192	19%	0.188	C	C	.	.	H	α-helix	trans	-61.9	-45.8	175.9	-75.3	-179.7	172.7	-176.1	-3.9	111.5	C203 K204 L205 A210 Y211 A221 I223 P255 F257	C203-R207 WeakPolarHBondContact O-CG 3.4Å; C203-R207 PolarHBondContact O-N 3.28Å; K204-R207 PolarHBondContact O-N 2.86Å; L205-R207 PolarHBondContact O-N 3.41Å; R207-A210 PolarHBondContact O-N 3.38Å; R207-Y211 HydrophobicContact CB-CE2 3.98Å; R207-Y211 WeakPolarHBondContact O-CD2 3.26Å; R207-Y211 WeakPolarHBondContact O-CE2 3.4Å; R207-Y211 VanDerWaalsContact O-CG 3.26Å; R207-Y211 PolarHBondContact O-N 2.59Å; R207-A221 HydrophobicContact CG-CB 4.18Å; R207-I223 HydrophobicContact CG-CD1 4.27Å; R207-P255 PolarHBondContact NH2-O 3.23Å; R207-F257 VanDerWaalsContact NH2-CE1 3.3Å
208	K	98.7	Very high	98.6	Very high	52 Å²	52	37.3 Å²	37.3	23%	0.226	21%	0.208	C	C	.	.	H	α-helix	trans	-65.6	-41.6	-178.5	-165.4	176.3	-178.9	84.5	0	112	K204 L205 Y211 S212 T366 I367 E371	K204-K208 VanDerWaalsContact O-CB 3.3Å; K204-K208 WeakPolarHBondContact O-CB 3.44Å; K204-K208 PolarHBondContact O-N 3.28Å; L205-K208 PolarHBondContact O-N 2.96Å; K208-Y211 PolarHBondContact O-N 2.81Å; K208-S212 VanDerWaalsContact O-CB 3.25Å; K208-S212 WeakPolarHBondContact O-CB 3.43Å; K208-S212 PolarHBondContact O-N 3.42Å; K208-S212 PolarHBondContact O-OG 3.38Å; K208-T366 WeakPolarHBondContact CD-O 3.41Å; K208-T366 WeakPolarHBondContact CE-O 3.28Å; K208-I367 HydrophobicContact CD-CG1 3.85Å; K208-E371 WeakPolarHBondContact CE-OE2 3.4Å; K208-E371 IonicContact NZ-OE1 3.36Å; K208-E371 PolarHBondContact NZ-OE1 2.67Å; K208-E371 IonicContact NZ-OE2 3.42Å; K208-E371 PolarHBondContact NZ-OE2 2.92Å
209	W	98.8	Very high	98.6	Very high	8 Å²	8	44.3 Å²	44.3	3%	0.03	25%	0.246	C	C	.	.	H	α-helix	trans	-60.6	-44.2	171.2	173.8	92.2	0	0	0	111.4	L205 Y211 S212 V213 K214 N310 L312 V363 T366	L205-W209 VanDerWaalsContact O-CB 3.31Å; L205-W209 WeakPolarHBondContact O-CB 3.44Å; L205-W209 PolarHBondContact O-N 3.19Å; W209-Y211 VanDerWaalsContact C-N 3.32Å; W209-Y211 PolarHBondContact O-N 3.4Å; W209-S212 PolarHBondContact O-N 3.25Å; W209-V213 HydrophobicContact CD2-CB 4.48Å; W209-V213 HydrophobicContact CG-CB 4.21Å; W209-V213 HydrophobicContact CG-CG2 4.35Å; W209-V213 WeakPolarHBondContact O-CA 3.34Å; W209-V213 VanDerWaalsContact O-CB 3.31Å; W209-V213 WeakPolarHBondContact O-CB 3.41Å; W209-V213 PolarHBondContact O-N 3.26Å; W209-K214 HydrophobicContact CE3-CB 4.25Å; W209-K214 HydrophobicContact CH2-CB 3.93Å; W209-K214 HydrophobicContact CH2-CD 3.93Å; W209-K214 HydrophobicContact CH2-CG 4.29Å; W209-K214 HydrophobicContact CZ2-CB 4.46Å; W209-K214 HydrophobicContact CZ3-CB 3.81Å; W209-K214 HydrophobicContact CZ3-CD 3.71Å; W209-K214 HydrophobicContact CZ3-CG 4.3Å; W209-K214 PolarHBondContact O-N 3.47Å; W209-K214 VanDerWaalsContact O-N 3.16Å; W209-N310 WeakPolarHBondContact CH2-O 3.16Å; W209-L312 HydrophobicContact CB-CD1 4.07Å; W209-L312 HydrophobicContact CD2-CD1 3.55Å; W209-L312 HydrophobicContact CD2-CD2 4.18Å; W209-L312 HydrophobicContact CD2-CG 3.92Å; W209-L312 HydrophobicContact CE3-CD1 3.44Å; W209-L312 VanDerWaalsContact CE3-CD1 3.44Å; W209-L312 HydrophobicContact CE3-CD2 4.37Å; W209-L312 HydrophobicContact CE3-CG 3.66Å; W209-L312 HydrophobicContact CG-CD1 3.83Å; W209-L312 HydrophobicContact CH2-CD2 4.3Å; W209-L312 HydrophobicContact CH2-CG 4.08Å; W209-L312 HydrophobicContact CZ2-CD2 4.1Å; W209-L312 HydrophobicContact CZ2-CG 4.31Å; W209-L312 HydrophobicContact CZ3-CD1 4.07Å; W209-L312 HydrophobicContact CZ3-CD2 4.42Å; W209-L312 HydrophobicContact CZ3-CG 3.75Å; W209-V363 HydrophobicContact CB-CG1 4.48Å; W209-V363 HydrophobicContact CG-CG2 4.33Å; W209-T366 HydrophobicContact CB-CG2 4.2Å
210	A	98.8	Very high	98.6	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.273	C	S	.	.	I	π-helix	trans	-61.5	-40.9	179.9	0	0	0	0	0	112.4	A206 R207 K214 G215 V216 A221 A278	A206-A210 VanDerWaalsContact O-CB 3.31Å; A206-A210 WeakPolarHBondContact O-CB 3.13Å; A206-A210 PolarHBondContact O-N 3.02Å; R207-A210 PolarHBondContact O-N 3.38Å; A210-K214 CarbonylContact O-C 3.49Å; A210-K214 WeakPolarHBondContact O-CB 3.21Å; A210-K214 PolarHBondContact O-N 2.74Å; A210-G215 PolarHBondContact O-N 3.03Å; A210-V216 HydrophobicContact CB-CB 4.22Å; A210-V216 HydrophobicContact CB-CG2 3.98Å; A210-V216 PolarHBondContact O-N 3.21Å; A210-A221 HydrophobicContact CB-CB 4.15Å; A210-A278 HydrophobicContact CB-CB 3.45Å; A210-A278 VanDerWaalsContact CB-CB 3.45Å
211	Y	98.7	Very high	98.6	Very high	58 Å²	58	48.4 Å²	48.4	23%	0.227	26%	0.263	C	S	.	.	I	π-helix	trans	-72.7	-41.8	176.8	-55.3	-41.9	0	0	0	112.9	R207 K208 W209 V216 P217 A221	R207-Y211 HydrophobicContact CB-CE2 3.98Å; R207-Y211 WeakPolarHBondContact O-CD2 3.26Å; R207-Y211 WeakPolarHBondContact O-CE2 3.4Å; R207-Y211 VanDerWaalsContact O-CG 3.26Å; R207-Y211 PolarHBondContact O-N 2.59Å; K208-Y211 PolarHBondContact O-N 2.81Å; W209-Y211 VanDerWaalsContact C-N 3.32Å; W209-Y211 PolarHBondContact O-N 3.4Å; Y211-V216 HydrophobicContact CD1-CB 4.35Å; Y211-V216 HydrophobicContact CD1-CG1 4.47Å; Y211-V216 WeakPolarHBondContact CD1-O 3.5Å; Y211-V216 HydrophobicContact CE1-CG1 4.36Å; Y211-P217 WeakPolarHBondContact CE1-O 3.41Å; Y211-A221 HydrophobicContact CD1-CB 4.27Å; Y211-A221 HydrophobicContact CE1-CB 3.39Å; Y211-A221 WeakPolarHBondContact OH-CB 3.48Å
212	S	98.1	Very high	98.6	Very high	82 Å²	82	50.8 Å²	50.8	57%	0.573	27%	0.274	S	S	*	.	I	π-helix	trans	-89.8	-27.4	-168.7	-45.8	0	0	0	0	113.6	K208 W209	K208-S212 VanDerWaalsContact O-CB 3.25Å; K208-S212 WeakPolarHBondContact O-CB 3.43Å; K208-S212 PolarHBondContact O-N 3.42Å; K208-S212 PolarHBondContact O-OG 3.38Å; W209-S212 PolarHBondContact O-N 3.25Å
213	V	98.4	Very high	98.6	Very high	84 Å²	84	50.8 Å²	50.8	51%	0.509	27%	0.274	S	S	.	.	I	π-helix	trans	-117.7	-55.2	-172.4	-175.2	0	0	0	0	110.7	W209 G215 T366	W209-V213 HydrophobicContact CD2-CB 4.48Å; W209-V213 HydrophobicContact CG-CB 4.21Å; W209-V213 HydrophobicContact CG-CG2 4.35Å; W209-V213 WeakPolarHBondContact O-CA 3.34Å; W209-V213 VanDerWaalsContact O-CB 3.31Å; W209-V213 WeakPolarHBondContact O-CB 3.41Å; W209-V213 PolarHBondContact O-N 3.26Å; V213-G215 VanDerWaalsContact C-N 3.3Å; V213-G215 PolarHBondContact O-N 3.07Å; V213-T366 HydrophobicContact CG2-CG2 4.07Å
214	K	98.4	Very high	98.6	Very high	38 Å²	38	50.6 Å²	50.6	17%	0.165	27%	0.272	C	S	.	.	I	π-helix	trans	-69.9	-26.4	179.9	-172.2	173.8	177.3	164.5	0	113	W209 A210 V216 Q275 V277 Y309 N310	W209-K214 HydrophobicContact CE3-CB 4.25Å; W209-K214 HydrophobicContact CH2-CB 3.93Å; W209-K214 HydrophobicContact CH2-CD 3.93Å; W209-K214 HydrophobicContact CH2-CG 4.29Å; W209-K214 HydrophobicContact CZ2-CB 4.46Å; W209-K214 HydrophobicContact CZ3-CB 3.81Å; W209-K214 HydrophobicContact CZ3-CD 3.71Å; W209-K214 HydrophobicContact CZ3-CG 4.3Å; W209-K214 PolarHBondContact O-N 3.47Å; W209-K214 VanDerWaalsContact O-N 3.16Å; A210-K214 CarbonylContact O-C 3.49Å; A210-K214 WeakPolarHBondContact O-CB 3.21Å; A210-K214 PolarHBondContact O-N 2.74Å; K214-V216 HydrophobicContact CB-CG2 4.39Å; K214-V216 HydrophobicContact CD-CG2 4.02Å; K214-V216 HydrophobicContact CG-CG2 4.13Å; K214-Q275 WeakPolarHBondContact CE-O 3.23Å; K214-V277 PolarHBondContact NZ-O 3.43Å; K214-Y309 PolarHBondContact NZ-O 2.72Å; K214-N310 WeakPolarHBondContact CD-O 3.32Å; K214-N310 VanDerWaalsContact CE-O 3.27Å; K214-N310 WeakPolarHBondContact CE-O 3.33Å; K214-N310 PolarHBondContact NZ-O 2.99Å
215	G	98.5	Very high	98.6	Very high	57 Å²	57	46.3 Å²	46.3	59%	0.588	25%	0.254	S	S	*	.			trans	83.4	22	179.9	0	0	0	0	0	114.5	A210 V213	A210-G215 PolarHBondContact O-N 3.03Å; V213-G215 VanDerWaalsContact C-N 3.3Å; V213-G215 PolarHBondContact O-N 3.07Å
216	V	98.8	Very high	98.6	Very high	7 Å²	7	46.4 Å²	46.4	4%	0.042	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-62.4	136.9	172.8	177.4	0	0	0	0	109.3	A210 Y211 K214 K220 A221 N276	A210-V216 HydrophobicContact CB-CB 4.22Å; A210-V216 HydrophobicContact CB-CG2 3.98Å; A210-V216 PolarHBondContact O-N 3.21Å; Y211-V216 HydrophobicContact CD1-CB 4.35Å; Y211-V216 HydrophobicContact CD1-CG1 4.47Å; Y211-V216 WeakPolarHBondContact CD1-O 3.5Å; Y211-V216 HydrophobicContact CE1-CG1 4.36Å; K214-V216 HydrophobicContact CB-CG2 4.39Å; K214-V216 HydrophobicContact CD-CG2 4.02Å; K214-V216 HydrophobicContact CG-CG2 4.13Å; V216-K220 HydrophobicContact CG1-CB 4.21Å; V216-A221 HydrophobicContact CG1-CB 4.13Å; V216-N276 HydrophobicContact CG1-CB 4.05Å
217	P	98.6	Very high	98.6	Very high	74 Å²	74	50.6 Å²	50.6	48%	0.481	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-58.6	145.4	177.3	-24.6	33.9	0	0	0	112.6	Y211 N219 K220	Y211-P217 WeakPolarHBondContact CE1-O 3.41Å; P217-N219 PolarHBondContact O-N 3.23Å; P217-K220 HydrophobicContact CB-CB 4.24Å; P217-K220 HydrophobicContact CB-CG 3.91Å; P217-K220 WeakPolarHBondContact O-CB 3.37Å; P217-K220 PolarHBondContact O-N 3.36Å
218	N	97.8	Very high	98.5	Very high	126 Å²	126	49.4 Å²	49.4	67%	0.674	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	135.3	179.4	-72.8	-21.8	0	0	0	111.6	K220	N218-K220 PolarHBondContact O-N 2.96Å
219	N	97.6	Very high	98.5	Very high	148 Å²	148	47.6 Å²	47.6	79%	0.791	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	14.5	-178.4	-54.1	-43.8	0	0	0	115.3	P217	P217-N219 PolarHBondContact O-N 3.23Å
220	K	98.6	Very high	98.4	Very high	132 Å²	132	50.3 Å²	50.3	57%	0.574	28%	0.282	S	S	*	.			trans	-104.9	-11.9	175.1	-61.2	-60.2	-173.3	176.9	0	114.6	V216 P217 N218 K222 N276	V216-K220 HydrophobicContact CG1-CB 4.21Å; P217-K220 HydrophobicContact CB-CB 4.24Å; P217-K220 HydrophobicContact CB-CG 3.91Å; P217-K220 WeakPolarHBondContact O-CB 3.37Å; P217-K220 PolarHBondContact O-N 3.36Å; N218-K220 PolarHBondContact O-N 2.96Å; K220-K222 PolarHBondContact O-N 3.2Å; K220-N276 WeakPolarHBondContact O-CB 3.44Å
221	A	98.8	Very high	98.4	Very high	3 Å²	3	50.9 Å²	50.9	3%	0.025	28%	0.284	C	S	.	.			trans	-58.2	132.5	-180	0	0	0	0	0	112.7	R207 A210 Y211 V216 N276 A278	R207-A221 HydrophobicContact CG-CB 4.18Å; A210-A221 HydrophobicContact CB-CB 4.15Å; Y211-A221 HydrophobicContact CD1-CB 4.27Å; Y211-A221 HydrophobicContact CE1-CB 3.39Å; Y211-A221 WeakPolarHBondContact OH-CB 3.48Å; V216-A221 HydrophobicContact CG1-CB 4.13Å; A221-N276 WeakPolarHBondContact CA-O 3.36Å; A221-A278 HydrophobicContact CB-CB 4.18Å
222	K	98.9	Very high	98.4	Very high	51 Å²	51	48.7 Å²	48.7	22%	0.222	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	147.9	177.1	-64.6	170.6	171	-166.9	0	111.1	K220 G256 E258 D274 N276 V277 A278	K220-K222 PolarHBondContact O-N 3.2Å; K222-G256 CarbonylContact C-O 3.47Å; K222-G256 WeakPolarHBondContact CA-O 3.41Å; K222-E258 VanDerWaalsContact CD-OE1 3.27Å; K222-E258 WeakPolarHBondContact CD-OE1 3.39Å; K222-E258 WeakPolarHBondContact CE-OE1 3.28Å; K222-E258 IonicContact NZ-OE1 3.11Å; K222-E258 PolarHBondContact NZ-OE1 3.44Å; K222-D274 WeakPolarHBondContact CD-OD2 3.49Å; K222-D274 VanDerWaalsContact CE-OD2 3.31Å; K222-D274 WeakPolarHBondContact CE-OD2 3.49Å; K222-D274 IonicContact NZ-OD2 2.73Å; K222-D274 PolarHBondContact NZ-OD2 2.78Å; K222-N276 PolarHBondContact N-O 3.26Å; K222-V277 HydrophobicContact CB-CG2 4.36Å; K222-A278 WeakPolarHBondContact O-CB 3.37Å; K222-A278 PolarHBondContact O-N 3.02Å
223	I	98.9	Very high	98.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	126.5	168.4	-57.3	-178.6	0	0	0	107.7	C203 A206 R207 F225 G256 F257 E258 A279 M281	C203-I223 HydrophobicContact CB-CD1 3.78Å; A206-I223 HydrophobicContact CB-CD1 4.25Å; R207-I223 HydrophobicContact CG-CD1 4.27Å; I223-F225 HydrophobicContact CB-CE2 3.88Å; I223-F225 HydrophobicContact CB-CZ 4.43Å; I223-F225 HydrophobicContact CG2-CD2 4.15Å; I223-F225 HydrophobicContact CG2-CE2 3.52Å; I223-F225 HydrophobicContact CG2-CZ 3.77Å; I223-G256 PolarHBondContact N-O 2.88Å; I223-F257 HydrophobicContact CB-CD1 4.01Å; I223-F257 HydrophobicContact CB-CE1 4.18Å; I223-F257 HydrophobicContact CD1-CE1 4.13Å; I223-F257 HydrophobicContact CG1-CE1 4.39Å; I223-F257 WeakPolarHBondContact O-CA 3.38Å; I223-E258 PolarHBondContact O-N 3.28Å; I223-A279 WeakPolarHBondContact CA-O 3.31Å; I223-A279 HydrophobicContact CG2-CB 4.26Å; I223-M281 HydrophobicContact CG2-CB 4.35Å
224	I	98.9	Very high	98.4	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	137.9	176.5	-57.8	168.7	0	0	0	108.3	E258 V260 A271 L272 V277 A279 F280 M281	I224-E258 CarbonylContact C-O 3.31Å; I224-E258 WeakPolarHBondContact CA-O 3.32Å; I224-E258 HydrophobicContact CG1-CB 4.48Å; I224-V260 HydrophobicContact CG2-CB 4.4Å; I224-V260 HydrophobicContact CG2-CG1 3.88Å; I224-V260 HydrophobicContact CG2-CG2 3.74Å; I224-A271 HydrophobicContact CD1-CB 3.58Å; I224-A271 HydrophobicContact CG1-CB 4.48Å; I224-L272 HydrophobicContact CD1-CD2 3.9Å; I224-L272 HydrophobicContact CD1-CG 4.34Å; I224-V277 HydrophobicContact CD1-CB 4.47Å; I224-V277 HydrophobicContact CD1-CG1 3.69Å; I224-V277 HydrophobicContact CD1-CG2 3.94Å; I224-V277 HydrophobicContact CG1-CG1 3.96Å; I224-V277 HydrophobicContact CG1-CG2 4.31Å; I224-A279 PolarHBondContact N-O 3.28Å; I224-F280 HydrophobicContact CB-CD2 3.9Å; I224-F280 HydrophobicContact CG2-CD2 3.72Å; I224-F280 HydrophobicContact CG2-CE2 4.1Å; I224-F280 WeakPolarHBondContact O-CA 3.3Å; I224-F280 WeakPolarHBondContact O-CD2 3.36Å; I224-M281 PolarHBondContact O-N 3.27Å
225	F	98.9	Very high	98.4	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.009	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	157.9	171.2	-64.9	-97.8	0	0	0	109.6	I223 W231 F257 E258 L259 V260 M281	I223-F225 HydrophobicContact CB-CE2 3.88Å; I223-F225 HydrophobicContact CB-CZ 4.43Å; I223-F225 HydrophobicContact CG2-CD2 4.15Å; I223-F225 HydrophobicContact CG2-CE2 3.52Å; I223-F225 HydrophobicContact CG2-CZ 3.77Å; F225-W231 AromaticContact CD1-NE1 3.9Å; F225-W231 AromaticContact CE1-CD1 4Å; F225-W231 AromaticContact CE1-CE2 3.76Å; F225-W231 HydrophobicContact CE1-CZ2 4.1Å; F225-W231 AromaticContact CE1-NE1 3.43Å; F225-W231 HydrophobicContact CZ-CZ2 4.02Å; F225-F257 HydrophobicContact CD2-CB 4.26Å; F225-F257 HydrophobicContact CD2-CG 4.34Å; F225-F257 HydrophobicContact CE2-CB 4.07Å; F225-F257 AromaticContact CE2-CD1 3.64Å; F225-F257 HydrophobicContact CE2-CD1 3.64Å; F225-F257 HydrophobicContact CE2-CD2 4.06Å; F225-F257 HydrophobicContact CE2-CE1 4.03Å; F225-F257 HydrophobicContact CE2-CE2 4.4Å; F225-F257 AromaticContact CE2-CG 3.68Å; F225-F257 HydrophobicContact CE2-CG 3.68Å; F225-F257 HydrophobicContact CE2-CZ 4.39Å; F225-F257 HydrophobicContact CZ-CD1 4.41Å; F225-F257 HydrophobicContact CZ-CE1 4.37Å; F225-F257 HydrophobicContact CZ-CZ 4.43Å; F225-E258 PolarHBondContact N-O 3.49Å; F225-L259 HydrophobicContact CB-CD2 3.78Å; F225-L259 WeakPolarHBondContact O-CA 3.46Å; F225-V260 PolarHBondContact O-N 2.95Å; F225-M281 HydrophobicContact CD1-CB 3.98Å; F225-M281 HydrophobicContact CD1-CG 4.27Å; F225-M281 HydrophobicContact CE1-CB 3.79Å; F225-M281 HydrophobicContact CE1-CG 3.95Å; F225-M281 HydrophobicContact CE1-SD 3.66Å; F225-M281 HydrophobicContact CZ-CB 4.42Å; F225-M281 HydrophobicContact CZ-SD 4.36Å
226	A	98.6	Very high	98.3	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.008	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	139.7	169.6	0	0	0	0	0	110.9	N229 V260 F262 V282	A226-N229 VanDerWaalsContact O-CB 3.23Å; A226-N229 WeakPolarHBondContact O-CB 3.45Å; A226-N229 PolarHBondContact O-N 2.91Å; A226-N229 VanDerWaalsContact O-N 3.15Å; A226-N229 PolarHBondContact O-ND2 3.33Å; A226-V260 CarbonylContact C-O 3.49Å; A226-V260 VanDerWaalsContact CA-O 3.26Å; A226-V260 WeakPolarHBondContact CA-O 3.19Å; A226-F262 HydrophobicContact CB-CB 3.99Å; A226-F262 HydrophobicContact CB-CD2 3.71Å; A226-F262 HydrophobicContact CB-CG 4.32Å; A226-V282 HydrophobicContact CB-CG2 4.01Å
227	E	98.5	Very high	98.3	Very high	89 Å²	89	50.3 Å²	50.3	42%	0.416	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	142.1	169.2	-66.5	177.5	171.7	0	0	110.6	N229 T242 L259 V260 Q286	E227-N229 VanDerWaalsContact C-N 3.29Å; E227-N229 PolarHBondContact O-N 2.98Å; E227-T242 HydrophobicContact CB-CG2 4.11Å; E227-T242 HydrophobicContact CG-CG2 4.02Å; E227-L259 HydrophobicContact CG-CB 4.17Å; E227-V260 PolarHBondContact N-O 3.06Å; E227-Q286 PolarHBondContact O-NE2 3.17Å
228	G	97	Very high	98.3	Very high	26 Å²	26	47.1 Å²	47.1	27%	0.268	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.4	4.9	-173.7	0	0	0	0	0	115.4	T242	G228-T242 PolarHBondContact N-OG1 3.14Å
229	N	98.2	Very high	98.3	Very high	14 Å²	14	42.2 Å²	42.2	8%	0.075	21%	0.213	C	C	.	.			trans	-59.3	148.5	175.5	68	95.8	0	0	0	112.8	A226 E227 W231 S240	A226-N229 VanDerWaalsContact O-CB 3.23Å; A226-N229 WeakPolarHBondContact O-CB 3.45Å; A226-N229 PolarHBondContact O-N 2.91Å; A226-N229 VanDerWaalsContact O-N 3.15Å; A226-N229 PolarHBondContact O-ND2 3.33Å; E227-N229 VanDerWaalsContact C-N 3.29Å; E227-N229 PolarHBondContact O-N 2.98Å; N229-W231 VanDerWaalsContact OD1-CD1 3.31Å; N229-S240 PolarHBondContact ND2-O 2.78Å; N229-S240 PolarHBondContact OD1-O 2.77Å; N229-S240 PolarHBondContact OD1-OG 3.02Å
230	F	98.3	Very high	98.4	Very high	64 Å²	64	35.2 Å²	35.2	28%	0.281	18%	0.175	S	C	.	.			trans	-140.4	112.1	166.3	-178	-89.4	0	0	0	111.2	R233 E283 E288	F230-R233 HydrophobicContact CE2-CG 4.48Å; F230-R233 HydrophobicContact CZ-CG 4.47Å; F230-E283 PolarHBondContact N-OE1 3.23Å; F230-E288 HydrophobicContact CB-CB 3.67Å; F230-E288 HydrophobicContact CB-CG 3.71Å; F230-E288 HydrophobicContact CD1-CB 4.28Å; F230-E288 HydrophobicContact CD1-CG 3.34Å; F230-E288 HydrophobicContact CD2-CB 4.45Å; F230-E288 HydrophobicContact CD2-CG 4.1Å; F230-E288 HydrophobicContact CE1-CG 3.93Å; F230-E288 HydrophobicContact CG-CB 3.89Å; F230-E288 HydrophobicContact CG-CG 3.43Å; F230-E288 VanDerWaalsContact CG-CG 3.43Å
231	W	98.3	Very high	98.3	Very high	12 Å²	12	29.8 Å²	29.8	5%	0.045	15%	0.154	C	C	.	.			trans	-126.8	3.4	176.3	62.8	-81.8	0	0	0	113.3	V196 G199 E200 F225 N229 A236 A237 S240 F257 M281 D316	V196-W231 VanDerWaalsContact CA-O 3.32Å; V196-W231 WeakPolarHBondContact CA-O 3.35Å; V196-W231 WeakPolarHBondContact CB-O 3.41Å; V196-W231 HydrophobicContact CG2-CE3 4.2Å; V196-W231 HydrophobicContact CG2-CZ3 4.26Å; G199-W231 VanDerWaalsContact C-CZ3 3.47Å; E200-W231 HydrophobicContact CG-CZ3 4.05Å; F225-W231 AromaticContact CD1-NE1 3.9Å; F225-W231 AromaticContact CE1-CD1 4Å; F225-W231 AromaticContact CE1-CE2 3.76Å; F225-W231 HydrophobicContact CE1-CZ2 4.1Å; F225-W231 AromaticContact CE1-NE1 3.43Å; F225-W231 HydrophobicContact CZ-CZ2 4.02Å; N229-W231 VanDerWaalsContact OD1-CD1 3.31Å; W231-A236 HydrophobicContact CH2-CB 3.94Å; W231-A236 HydrophobicContact CZ2-CB 4.43Å; W231-A237 HydrophobicContact CD2-CB 3.8Å; W231-A237 VanDerWaalsContact CE2-CA 3.41Å; W231-A237 HydrophobicContact CE3-CB 3.97Å; W231-A237 HydrophobicContact CG-CB 4.43Å; W231-A237 HydrophobicContact CH2-CB 4.09Å; W231-A237 HydrophobicContact CZ2-CB 3.92Å; W231-A237 HydrophobicContact CZ3-CB 4.09Å; W231-S240 PolarHBondContact NE1-OG 2.79Å; W231-F257 HydrophobicContact CZ2-CE2 4.36Å; W231-M281 HydrophobicContact CB-CE 3.57Å; W231-M281 HydrophobicContact CD2-CE 4.01Å; W231-M281 HydrophobicContact CE3-CE 4.34Å; W231-M281 HydrophobicContact CG-CE 3.75Å; W231-D316 WeakPolarHBondContact CB-OD2 3.25Å
232	G	97.6	Very high	98.3	Very high	13 Å²	13	32.5 Å²	32.5	13%	0.134	17%	0.171	C	C	.	.			trans	156.2	-165	175.8	0	0	0	0	0	115.7	A237	G232-A237 VanDerWaalsContact C-CB 3.46Å
233	R	98.1	Very high	98.1	Very high	143 Å²	143	32 Å²	32	54%	0.54	17%	0.17	S	C	.	.	S	Bend	trans	-132.6	15.3	-176.5	-64.9	-73.5	-176.6	168.2	-14.8	113.1	F230 S246	F230-R233 HydrophobicContact CE2-CG 4.48Å; F230-R233 HydrophobicContact CZ-CG 4.47Å; R233-S246 VanDerWaalsContact NH1-CA 3.33Å; R233-S246 PolarHBondContact NH1-OG 2.77Å; R233-S246 PolarHBondContact NH2-OG 2.75Å
234	T	98.4	Very high	97.9	Very high	45 Å²	45	34.8 Å²	34.8	28%	0.276	19%	0.188	S	C	.	.	S	Bend	trans	-72.7	165.7	170.6	57.7	0	0	0	0	110.3	V196 E200 A236 A237 I238	V196-T234 HydrophobicContact CG1-CG2 4.21Å; V196-T234 HydrophobicContact CG2-CG2 3.53Å; V196-T234 WeakPolarHBondContact CG2-OG1 3.34Å; E200-T234 WeakPolarHBondContact OE1-CB 3.4Å; E200-T234 PolarHBondContact OE1-OG1 3.36Å; T234-A236 PolarHBondContact O-N 3.35Å; T234-A237 PolarHBondContact O-N 2.84Å; T234-A237 VanDerWaalsContact O-N 3.08Å; T234-A237 PolarHBondContact OG1-N 3.14Å; T234-I238 WeakPolarHBondContact O-CG1 3.43Å; T234-I238 WeakPolarHBondContact O-CG2 3.49Å; T234-I238 PolarHBondContact O-N 2.98Å
235	L	98.4	Very high	97.6	Very high	108 Å²	108	39 Å²	39	57%	0.565	22%	0.218	S	C	*	.	H	α-helix	trans	-55	-38.8	174.2	-71.2	177.7	0	0	0	112.1	I238 S239 F250	L235-I238 HydrophobicContact CD2-CD1 3.99Å; L235-I238 WeakPolarHBondContact O-CG1 3.46Å; L235-S239 WeakPolarHBondContact O-CB 3.45Å; L235-S239 PolarHBondContact O-N 2.89Å; L235-S239 PolarHBondContact O-OG 3.05Å; L235-F250 HydrophobicContact CD2-CB 4.33Å; L235-F250 WeakPolarHBondContact CD2-O 3.31Å
236	A	98.1	Very high	97.4	Very high	3 Å²	3	39 Å²	39	3%	0.025	22%	0.218	C	C	.	.	H	α-helix	trans	-67.8	-44	175.9	0	0	0	0	0	111.6	E200 W231 T234 I238 S239 M254 F257	E200-A236 VanDerWaalsContact OE1-CB 3.23Å; E200-A236 WeakPolarHBondContact OE1-CB 3.49Å; W231-A236 HydrophobicContact CH2-CB 3.94Å; W231-A236 HydrophobicContact CZ2-CB 4.43Å; T234-A236 PolarHBondContact O-N 3.35Å; A236-I238 PolarHBondContact O-N 3.25Å; A236-S239 VanDerWaalsContact O-CB 3.3Å; A236-S239 WeakPolarHBondContact O-CB 3.21Å; A236-S239 PolarHBondContact O-N 3.02Å; A236-S239 VanDerWaalsContact O-N 3.1Å; A236-M254 HydrophobicContact CB-CE 4.34Å; A236-F257 HydrophobicContact CB-CE2 4.01Å; A236-F257 HydrophobicContact CB-CZ 4.31Å; A236-F257 VanDerWaalsContact O-CE2 3.31Å; A236-F257 WeakPolarHBondContact O-CE2 3.29Å
237	A	98.4	Very high	97.3	Very high	2 Å²	2	42.1 Å²	42.1	2%	0.017	23%	0.23	C	C	.	.	H	α-helix	trans	-60.2	-46.5	179.4	0	0	0	0	0	113.3	V196 W231 G232 T234 S239 S240	V196-A237 HydrophobicContact CG2-CB 4.17Å; W231-A237 HydrophobicContact CD2-CB 3.8Å; W231-A237 VanDerWaalsContact CE2-CA 3.41Å; W231-A237 HydrophobicContact CE3-CB 3.97Å; W231-A237 HydrophobicContact CG-CB 4.43Å; W231-A237 HydrophobicContact CH2-CB 4.09Å; W231-A237 HydrophobicContact CZ2-CB 3.92Å; W231-A237 HydrophobicContact CZ3-CB 4.09Å; G232-A237 VanDerWaalsContact C-CB 3.46Å; T234-A237 PolarHBondContact O-N 2.84Å; T234-A237 VanDerWaalsContact O-N 3.08Å; T234-A237 PolarHBondContact OG1-N 3.14Å; A237-S239 PolarHBondContact O-N 3.21Å; A237-S240 PolarHBondContact O-N 2.99Å; A237-S240 PolarHBondContact O-OG 3.03Å
238	I	98.4	Very high	97.2	Very high	8 Å²	8	43.8 Å²	43.8	4%	0.041	24%	0.238	C	C	.	.	H	α-helix	trans	-70.5	-19.6	178.9	71.7	-179.7	0	0	0	112.1	T234 L235 A236 S240 S241 S246 Y247 F250	T234-I238 WeakPolarHBondContact O-CG1 3.43Å; T234-I238 WeakPolarHBondContact O-CG2 3.49Å; T234-I238 PolarHBondContact O-N 2.98Å; L235-I238 HydrophobicContact CD2-CD1 3.99Å; L235-I238 WeakPolarHBondContact O-CG1 3.46Å; A236-I238 PolarHBondContact O-N 3.25Å; I238-S240 PolarHBondContact O-N 2.96Å; I238-S241 WeakPolarHBondContact O-CB 3.29Å; I238-S241 PolarHBondContact O-N 2.8Å; I238-S241 VanDerWaalsContact O-N 3.15Å; I238-S246 WeakPolarHBondContact CB-O 3.23Å; I238-S246 WeakPolarHBondContact CG2-O 3.48Å; I238-Y247 WeakPolarHBondContact O-CB 3.26Å; I238-F250 HydrophobicContact CD1-CB 3.39Å; I238-F250 HydrophobicContact CD1-CD2 3.87Å; I238-F250 HydrophobicContact CD1-CG 3.91Å
239	S	98.4	Very high	97.3	Very high	23 Å²	23	46.4 Å²	46.4	16%	0.161	27%	0.265	C	S	.	.	H	α-helix	trans	-72.3	-16.2	176.8	-60.7	0	0	0	0	113.8	L235 A236 A237 Y253 M254	L235-S239 WeakPolarHBondContact O-CB 3.45Å; L235-S239 PolarHBondContact O-N 2.89Å; L235-S239 PolarHBondContact O-OG 3.05Å; A236-S239 VanDerWaalsContact O-CB 3.3Å; A236-S239 WeakPolarHBondContact O-CB 3.21Å; A236-S239 PolarHBondContact O-N 3.02Å; A236-S239 VanDerWaalsContact O-N 3.1Å; A237-S239 PolarHBondContact O-N 3.21Å; S239-Y253 WeakPolarHBondContact OG-CA 3.41Å; S239-Y253 WeakPolarHBondContact OG-CB 3.33Å; S239-M254 WeakPolarHBondContact OG-CB 3.47Å; S239-M254 PolarHBondContact OG-N 3.07Å
240	S	98.2	Very high	97.2	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	8.7	170.2	68.9	0	0	0	0	112.3	N229 W231 A237 I238 L259	N229-S240 PolarHBondContact ND2-O 2.78Å; N229-S240 PolarHBondContact OD1-O 2.77Å; N229-S240 PolarHBondContact OD1-OG 3.02Å; W231-S240 PolarHBondContact NE1-OG 2.79Å; A237-S240 PolarHBondContact O-N 2.99Å; A237-S240 PolarHBondContact O-OG 3.03Å; I238-S240 PolarHBondContact O-N 2.96Å; S240-L259 WeakPolarHBondContact O-CD2 3.44Å
241	S	97.9	Very high	97.1	Very high	18 Å²	18	50.3 Å²	50.3	13%	0.126	29%	0.294	C	S	.	.			trans	-85.2	145.1	-177	-170.2	0	0	0	0	111.9	I238 D243	I238-S241 WeakPolarHBondContact O-CB 3.29Å; I238-S241 PolarHBondContact O-N 2.8Å; I238-S241 VanDerWaalsContact O-N 3.15Å; S241-D243 PolarHBondContact OG-N 3.21Å; S241-D243 VanDerWaalsContact OG-N 3.15Å
242	T	97	Very high	97	Very high	61 Å²	61	55.8 Å²	55.8	37%	0.374	33%	0.331	S	S	.	.			trans	-102.6	0.8	167.4	54.8	0	0	0	0	112.8	E227 G228 P244 L259	E227-T242 HydrophobicContact CB-CG2 4.11Å; E227-T242 HydrophobicContact CG-CG2 4.02Å; G228-T242 PolarHBondContact N-OG1 3.14Å; T242-P244 WeakPolarHBondContact O-CD 3.49Å; T242-L259 HydrophobicContact CG2-CD1 3.58Å
243	D	95.4	Very high	97	Very high	41 Å²	41	60 Å²	60	22%	0.219	34%	0.343	C	S	.	.			trans	-89	112	176.9	166.4	19.7	0	0	0	109.4	S241 S245 S246 Y247	S241-D243 PolarHBondContact OG-N 3.21Å; S241-D243 VanDerWaalsContact OG-N 3.15Å; D243-S245 PolarHBondContact O-N 2.98Å; D243-S245 WeakPolarHBondContact OD1-CB 3.3Å; D243-S245 PolarHBondContact OD1-N 2.9Å; D243-S245 PolarHBondContact OD1-OG 2.88Å; D243-S245 PolarHBondContact OD2-OG 3.29Å; D243-S246 WeakPolarHBondContact O-CA 3.35Å; D243-S246 VanDerWaalsContact O-CB 3.32Å; D243-S246 WeakPolarHBondContact O-CB 3.34Å; D243-S246 PolarHBondContact O-N 2.96Å; D243-S246 PolarHBondContact OD2-OG 3.42Å; D243-Y247 WeakPolarHBondContact O-CD1 3.41Å; D243-Y247 PolarHBondContact O-N 3.23Å
244	P	94.7	Very high	96.9	Very high	57 Å²	57	56.7 Å²	56.7	37%	0.37	34%	0.335	S	S	.	.	H	α-helix	trans	-57.2	-36.7	-177.9	-23.9	34.4	0	0	0	113	T242 S246 Y247 E248	T242-P244 WeakPolarHBondContact O-CD 3.49Å; P244-S246 PolarHBondContact O-N 3.39Å; P244-S246 VanDerWaalsContact O-N 3.09Å; P244-Y247 HydrophobicContact CB-CE1 4.47Å; P244-Y247 PolarHBondContact O-N 2.85Å; P244-E248 HydrophobicContact CB-CG 4.05Å; P244-E248 WeakPolarHBondContact CB-OE1 3.48Å; P244-E248 VanDerWaalsContact O-CB 3.31Å; P244-E248 WeakPolarHBondContact O-CB 3.46Å; P244-E248 VanDerWaalsContact O-CG 3.28Å; P244-E248 WeakPolarHBondContact O-CG 3.41Å; P244-E248 PolarHBondContact O-N 2.91Å
245	S	93.3	Very high	96.9	Very high	89 Å²	89	59.4 Å²	59.4	62%	0.622	35%	0.353	S	S	*	.	H	α-helix	trans	-65.5	-16.3	178.4	78.2	0	0	0	0	113.1	D243	D243-S245 PolarHBondContact O-N 2.98Å; D243-S245 WeakPolarHBondContact OD1-CB 3.3Å; D243-S245 PolarHBondContact OD1-N 2.9Å; D243-S245 PolarHBondContact OD1-OG 2.88Å; D243-S245 PolarHBondContact OD2-OG 3.29Å
246	S	94.4	Very high	96.8	Very high	3 Å²	3	55.5 Å²	55.5	2%	0.021	34%	0.339	C	S	.	.	H	α-helix	trans	-89.4	-30.3	177.6	-68.7	0	0	0	0	114	R233 I238 D243 P244	R233-S246 VanDerWaalsContact NH1-CA 3.33Å; R233-S246 PolarHBondContact NH1-OG 2.77Å; R233-S246 PolarHBondContact NH2-OG 2.75Å; I238-S246 WeakPolarHBondContact CB-O 3.23Å; I238-S246 WeakPolarHBondContact CG2-O 3.48Å; D243-S246 WeakPolarHBondContact O-CA 3.35Å; D243-S246 VanDerWaalsContact O-CB 3.32Å; D243-S246 WeakPolarHBondContact O-CB 3.34Å; D243-S246 PolarHBondContact O-N 2.96Å; D243-S246 PolarHBondContact OD2-OG 3.42Å; P244-S246 PolarHBondContact O-N 3.39Å; P244-S246 VanDerWaalsContact O-N 3.09Å
247	Y	95.8	Very high	96.9	Very high	66 Å²	66	56.9 Å²	56.9	26%	0.259	35%	0.345	S	S	.	.	H	α-helix	trans	-119.9	-21.5	-172.4	71.6	-104.7	0	0	0	115.7	I238 D243 P244 G249 F250 Y253	I238-Y247 WeakPolarHBondContact O-CB 3.26Å; D243-Y247 WeakPolarHBondContact O-CD1 3.41Å; D243-Y247 PolarHBondContact O-N 3.23Å; P244-Y247 HydrophobicContact CB-CE1 4.47Å; P244-Y247 PolarHBondContact O-N 2.85Å; Y247-G249 PolarHBondContact O-N 2.77Å; Y247-F250 PolarHBondContact O-N 3.25Å; Y247-Y253 HydrophobicContact CD2-CE1 4.42Å; Y247-Y253 HydrophobicContact CD2-CE2 4.33Å; Y247-Y253 AromaticContact CD2-CZ 3.81Å; Y247-Y253 WeakPolarHBondContact CD2-OH 3.35Å; Y247-Y253 PolarHBondContact O-OH 2.93Å; Y247-Y253 VanDerWaalsContact O-OH 3.08Å
248	E	97.5	Very high	96.8	Very high	123 Å²	123	59.9 Å²	59.9	58%	0.575	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	131.9	-174.5	-77.6	-176.6	169.1	0	0	112.4	P244 F250	P244-E248 HydrophobicContact CB-CG 4.05Å; P244-E248 WeakPolarHBondContact CB-OE1 3.48Å; P244-E248 VanDerWaalsContact O-CB 3.31Å; P244-E248 WeakPolarHBondContact O-CB 3.46Å; P244-E248 VanDerWaalsContact O-CG 3.28Å; P244-E248 WeakPolarHBondContact O-CG 3.41Å; P244-E248 PolarHBondContact O-N 2.91Å; E248-F250 VanDerWaalsContact C-N 3.35Å; E248-F250 PolarHBondContact O-N 3.04Å
249	G	97.5	Very high	96.9	Very high	81 Å²	81	62.7 Å²	62.7	84%	0.835	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	1.8	178.4	0	0	0	0	0	115.9	Y247	Y247-G249 PolarHBondContact O-N 2.77Å
250	F	97.9	Very high	96.9	Very high	117 Å²	117	62 Å²	62	51%	0.513	37%	0.368	S	S	.	.			trans	-108.6	4.9	-176.9	-60	-58	0	0	0	115.5	L235 I238 Y247 E248	L235-F250 HydrophobicContact CD2-CB 4.33Å; L235-F250 WeakPolarHBondContact CD2-O 3.31Å; I238-F250 HydrophobicContact CD1-CB 3.39Å; I238-F250 HydrophobicContact CD1-CD2 3.87Å; I238-F250 HydrophobicContact CD1-CG 3.91Å; Y247-F250 PolarHBondContact O-N 3.25Å; E248-F250 VanDerWaalsContact C-N 3.35Å; E248-F250 PolarHBondContact O-N 3.04Å
251	G	95.9	Very high	96.9	Very high	44 Å²	44	64.2 Å²	64.2	45%	0.454	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-65.8	166.5	-178.6	0	0	0	0	0	114.7
252	P	96.5	Very high	96.9	Very high	127 Å²	127	64.8 Å²	64.8	83%	0.825	38%	0.383	S	S	*	.	S	Bend	cis	-77.4	149.4	5.4	31.6	-36	0	0	0	114.1
253	Y	96.9	Very high	97	Very high	100 Å²	100	64.1 Å²	64.1	39%	0.392	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-87.3	156.4	-175.4	-52.7	-51.3	0	0	0	113.2	S239 Y247 P255	S239-Y253 WeakPolarHBondContact OG-CA 3.41Å; S239-Y253 WeakPolarHBondContact OG-CB 3.33Å; Y247-Y253 HydrophobicContact CD2-CE1 4.42Å; Y247-Y253 HydrophobicContact CD2-CE2 4.33Å; Y247-Y253 AromaticContact CD2-CZ 3.81Å; Y247-Y253 WeakPolarHBondContact CD2-OH 3.35Å; Y247-Y253 PolarHBondContact O-OH 2.93Å; Y247-Y253 VanDerWaalsContact O-OH 3.08Å; Y253-P255 WeakPolarHBondContact O-CD 3.45Å
254	M	96.3	Very high	97.2	Very high	75 Å²	75	65 Å²	65	37%	0.369	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-61.8	119.3	176.4	-176.8	63.7	67.5	0	0	110.5	A236 S239 F257	A236-M254 HydrophobicContact CB-CE 4.34Å; S239-M254 WeakPolarHBondContact OG-CB 3.47Å; S239-M254 PolarHBondContact OG-N 3.07Å; M254-F257 HydrophobicContact CB-CD2 4.24Å; M254-F257 HydrophobicContact CB-CE2 3.97Å; M254-F257 HydrophobicContact CG-CD2 4.24Å; M254-F257 HydrophobicContact CG-CE1 4.44Å; M254-F257 HydrophobicContact CG-CE2 3.74Å; M254-F257 HydrophobicContact CG-CZ 3.86Å
255	P	97.2	Very high	97.4	Very high	101 Å²	101	64.3 Å²	64.3	66%	0.656	37%	0.374	S	S	*	.	S	Bend	trans	-73.7	162.9	176.5	31.5	-36	0	0	0	111.6	R207 Y253	R207-P255 PolarHBondContact NH2-O 3.23Å; Y253-P255 WeakPolarHBondContact O-CD 3.45Å
256	G	97.8	Very high	97.6	Very high	26 Å²	26	64.6 Å²	64.6	27%	0.268	37%	0.374	S	S	.	.	S	Bend	trans	78.7	20.3	176.5	0	0	0	0	0	113.9	K222 I223	K222-G256 CarbonylContact C-O 3.47Å; K222-G256 WeakPolarHBondContact CA-O 3.41Å; I223-G256 PolarHBondContact N-O 2.88Å
257	F	98.4	Very high	97.8	Very high	32 Å²	32	65.7 Å²	65.7	14%	0.14	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	137.4	164.5	-63.5	-19.3	0	0	0	109.3	R207 I223 F225 W231 A236 M254	R207-F257 VanDerWaalsContact NH2-CE1 3.3Å; I223-F257 HydrophobicContact CB-CD1 4.01Å; I223-F257 HydrophobicContact CB-CE1 4.18Å; I223-F257 HydrophobicContact CD1-CE1 4.13Å; I223-F257 HydrophobicContact CG1-CE1 4.39Å; I223-F257 WeakPolarHBondContact O-CA 3.38Å; F225-F257 HydrophobicContact CD2-CB 4.26Å; F225-F257 HydrophobicContact CD2-CG 4.34Å; F225-F257 HydrophobicContact CE2-CB 4.07Å; F225-F257 AromaticContact CE2-CD1 3.64Å; F225-F257 HydrophobicContact CE2-CD1 3.64Å; F225-F257 HydrophobicContact CE2-CD2 4.06Å; F225-F257 HydrophobicContact CE2-CE1 4.03Å; F225-F257 HydrophobicContact CE2-CE2 4.4Å; F225-F257 AromaticContact CE2-CG 3.68Å; F225-F257 HydrophobicContact CE2-CG 3.68Å; F225-F257 HydrophobicContact CE2-CZ 4.39Å; F225-F257 HydrophobicContact CZ-CD1 4.41Å; F225-F257 HydrophobicContact CZ-CE1 4.37Å; F225-F257 HydrophobicContact CZ-CZ 4.43Å; W231-F257 HydrophobicContact CZ2-CE2 4.36Å; A236-F257 HydrophobicContact CB-CE2 4.01Å; A236-F257 HydrophobicContact CB-CZ 4.31Å; A236-F257 VanDerWaalsContact O-CE2 3.31Å; A236-F257 WeakPolarHBondContact O-CE2 3.29Å; M254-F257 HydrophobicContact CB-CD2 4.24Å; M254-F257 HydrophobicContact CB-CE2 3.97Å; M254-F257 HydrophobicContact CG-CD2 4.24Å; M254-F257 HydrophobicContact CG-CE1 4.44Å; M254-F257 HydrophobicContact CG-CE2 3.74Å; M254-F257 HydrophobicContact CG-CZ 3.86Å
258	E	98.3	Very high	98	Very high	66 Å²	66	62.5 Å²	62.5	31%	0.308	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	154.5	178.5	-67.2	-172.6	171.3	0	0	109.8	K222 I223 I224 F225	K222-E258 VanDerWaalsContact CD-OE1 3.27Å; K222-E258 WeakPolarHBondContact CD-OE1 3.39Å; K222-E258 WeakPolarHBondContact CE-OE1 3.28Å; K222-E258 IonicContact NZ-OE1 3.11Å; K222-E258 PolarHBondContact NZ-OE1 3.44Å; I223-E258 PolarHBondContact O-N 3.28Å; I224-E258 CarbonylContact C-O 3.31Å; I224-E258 WeakPolarHBondContact CA-O 3.32Å; I224-E258 HydrophobicContact CG1-CB 4.48Å; F225-E258 PolarHBondContact N-O 3.49Å
259	L	98.7	Very high	98	Very high	66 Å²	66	59.5 Å²	59.5	35%	0.346	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	141.5	-177.3	-71.4	164.7	0	0	0	110.9	F225 E227 S240 T242	F225-L259 HydrophobicContact CB-CD2 3.78Å; F225-L259 WeakPolarHBondContact O-CA 3.46Å; E227-L259 HydrophobicContact CG-CB 4.17Å; S240-L259 WeakPolarHBondContact O-CD2 3.44Å; T242-L259 HydrophobicContact CG2-CD1 3.58Å
260	V	98.8	Very high	98.1	Very high	8 Å²	8	63.1 Å²	63.1	5%	0.048	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	151.2	167.6	-62.9	0	0	0	0	109.3	I224 F225 A226 E227 F262 A267 L268 A271 F280	I224-V260 HydrophobicContact CG2-CB 4.4Å; I224-V260 HydrophobicContact CG2-CG1 3.88Å; I224-V260 HydrophobicContact CG2-CG2 3.74Å; F225-V260 PolarHBondContact O-N 2.95Å; A226-V260 CarbonylContact C-O 3.49Å; A226-V260 VanDerWaalsContact CA-O 3.26Å; A226-V260 WeakPolarHBondContact CA-O 3.19Å; E227-V260 PolarHBondContact N-O 3.06Å; V260-F262 PolarHBondContact O-N 3.16Å; V260-A267 HydrophobicContact CB-CB 4.42Å; V260-L268 HydrophobicContact CG2-CD1 4.43Å; V260-A271 HydrophobicContact CG1-CB 3.71Å; V260-F280 HydrophobicContact CG2-CE2 4.18Å
261	P	98.7	Very high	98.1	Very high	48 Å²	48	58.5 Å²	58.5	31%	0.312	33%	0.333	S	S	.	.			trans	-55.7	138.8	174	-25.4	34.9	0	0	0	111.8	D264	P261-D264 HydrophobicContact CB-CB 3.96Å
262	F	98.7	Very high	98.3	Very high	29 Å²	29	56.4 Å²	56.4	13%	0.127	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	144.7	173.6	-174.9	-117.5	0	0	0	110.4	A226 V260 D264 V282 Q286 V292 P294 Y298	A226-F262 HydrophobicContact CB-CB 3.99Å; A226-F262 HydrophobicContact CB-CD2 3.71Å; A226-F262 HydrophobicContact CB-CG 4.32Å; V260-F262 PolarHBondContact O-N 3.16Å; F262-D264 PolarHBondContact O-N 3.24Å; F262-V282 HydrophobicContact CD2-CG2 3.96Å; F262-V282 HydrophobicContact CE2-CG2 3.69Å; F262-Q286 HydrophobicContact CD1-CG 4.08Å; F262-Q286 HydrophobicContact CD2-CG 4.03Å; F262-Q286 HydrophobicContact CE1-CG 4.02Å; F262-Q286 HydrophobicContact CE2-CG 3.96Å; F262-Q286 VanDerWaalsContact CG-CD 3.5Å; F262-Q286 HydrophobicContact CG-CG 4.08Å; F262-Q286 HydrophobicContact CZ-CG 3.96Å; F262-V292 HydrophobicContact CD1-CG1 3.99Å; F262-V292 HydrophobicContact CE1-CB 4.37Å; F262-V292 HydrophobicContact CE1-CG1 4Å; F262-P294 HydrophobicContact CE1-CB 3.94Å; F262-P294 HydrophobicContact CE1-CG 4.42Å; F262-P294 HydrophobicContact CZ-CB 3.81Å; F262-P294 HydrophobicContact CZ-CG 3.97Å; F262-Y298 HydrophobicContact CD2-CE1 4.39Å; F262-Y298 AromaticContact CE2-CE1 3.86Å; F262-Y298 HydrophobicContact CE2-CE1 3.86Å; F262-Y298 HydrophobicContact CZ-CE1 4.42Å
263	N	98.5	Very high	98.4	Very high	47 Å²	47	55.6 Å²	55.6	25%	0.251	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	25.6	-179.5	-164	48.2	0	0	0	114.9	P294 D295 Y298	N263-P294 HydrophobicContact CB-CB 4.18Å; N263-P294 WeakPolarHBondContact OD1-CB 3.32Å; N263-D295 PolarHBondContact ND2-N 3.09Å; N263-D295 PolarHBondContact ND2-OD2 3.08Å; N263-D295 PolarHBondContact OD1-N 3.01Å; N263-Y298 VanDerWaalsContact CA-CE2 3.44Å
264	D	98.8	Very high	98.5	Very high	60 Å²	60	53 Å²	53	32%	0.321	29%	0.289	S	S	.	.			trans	-116.4	97	176.2	-170	-33.3	0	0	0	111.2	P261 F262 P266 A267 L268	P261-D264 HydrophobicContact CB-CB 3.96Å; F262-D264 PolarHBondContact O-N 3.24Å; D264-P266 WeakPolarHBondContact OD1-CD 3.15Å; D264-A267 HydrophobicContact CB-CB 3.97Å; D264-A267 VanDerWaalsContact CG-CB 3.45Å; D264-A267 WeakPolarHBondContact OD1-CB 3.36Å; D264-A267 PolarHBondContact OD1-N 3.1Å; D264-L268 WeakPolarHBondContact O-CB 3.31Å; D264-L268 PolarHBondContact O-N 2.97Å; D264-L268 VanDerWaalsContact O-N 3.08Å
265	I	98.8	Very high	98.5	Very high	42 Å²	42	55.6 Å²	55.6	22%	0.215	30%	0.3	C	S	.	.	H	α-helix	trans	-66.6	-45	-179.2	-65.9	-58.2	0	0	0	112.8	A267 L268 E269 Y298 K301 V302 L305	I265-A267 VanDerWaalsContact C-N 3.35Å; I265-A267 PolarHBondContact O-N 3.45Å; I265-L268 PolarHBondContact O-N 3.08Å; I265-E269 WeakPolarHBondContact O-CB 3.06Å; I265-E269 PolarHBondContact O-N 2.91Å; I265-Y298 HydrophobicContact CD1-CD2 3.47Å; I265-Y298 VanDerWaalsContact CD1-CD2 3.47Å; I265-Y298 HydrophobicContact CD1-CE2 3.63Å; I265-Y298 HydrophobicContact CG1-CD2 4Å; I265-Y298 HydrophobicContact CG1-CE2 4.38Å; I265-K301 HydrophobicContact CD1-CB 3.53Å; I265-K301 HydrophobicContact CG1-CB 3.95Å; I265-K301 HydrophobicContact CG1-CG 4.5Å; I265-K301 HydrophobicContact CG2-CB 4.32Å; I265-V302 HydrophobicContact CD1-CG2 4.44Å; I265-L305 HydrophobicContact CG2-CD1 3.92Å
266	P	98.8	Very high	98.6	Very high	96 Å²	96	53 Å²	53	62%	0.623	28%	0.281	S	S	*	.	H	α-helix	trans	-56.3	-43.1	173.9	-28.4	35.4	0	0	0	114.2	D264 K270	D264-P266 WeakPolarHBondContact OD1-CD 3.15Å; P266-K270 WeakPolarHBondContact O-CB 3.35Å; P266-K270 PolarHBondContact O-N 2.95Å
267	A	98.8	Very high	98.7	Very high	25 Å²	25	51.8 Å²	51.8	21%	0.207	27%	0.268	C	S	.	.	H	α-helix	trans	-65	-44.6	177.4	0	0	0	0	0	111.6	V260 D264 I265 K270 A271	V260-A267 HydrophobicContact CB-CB 4.42Å; D264-A267 HydrophobicContact CB-CB 3.97Å; D264-A267 VanDerWaalsContact CG-CB 3.45Å; D264-A267 WeakPolarHBondContact OD1-CB 3.36Å; D264-A267 PolarHBondContact OD1-N 3.1Å; I265-A267 VanDerWaalsContact C-N 3.35Å; I265-A267 PolarHBondContact O-N 3.45Å; A267-K270 PolarHBondContact O-N 3.29Å; A267-A271 PolarHBondContact O-N 3.24Å
268	L	98.9	Very high	98.7	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.2	-50.3	175.3	177.8	62	0	0	0	111.6	V260 D264 I265 K270 A271 L272 F280 V302 L305	V260-L268 HydrophobicContact CG2-CD1 4.43Å; D264-L268 WeakPolarHBondContact O-CB 3.31Å; D264-L268 PolarHBondContact O-N 2.97Å; D264-L268 VanDerWaalsContact O-N 3.08Å; I265-L268 PolarHBondContact O-N 3.08Å; L268-K270 VanDerWaalsContact C-N 3.29Å; L268-K270 PolarHBondContact O-N 3.12Å; L268-A271 PolarHBondContact O-N 3.14Å; L268-A271 VanDerWaalsContact O-N 3.14Å; L268-L272 HydrophobicContact CD1-CD1 3.86Å; L268-L272 HydrophobicContact CD1-CD2 4.32Å; L268-L272 HydrophobicContact CD1-CG 3.92Å; L268-L272 HydrophobicContact CD2-CD1 4.41Å; L268-L272 HydrophobicContact CG-CD1 3.75Å; L268-L272 HydrophobicContact CG-CG 4.24Å; L268-L272 VanDerWaalsContact O-CG 3.26Å; L268-L272 WeakPolarHBondContact O-CG 3.42Å; L268-L272 PolarHBondContact O-N 3.24Å; L268-F280 HydrophobicContact CD1-CB 4.4Å; L268-F280 HydrophobicContact CD1-CD1 3.89Å; L268-F280 HydrophobicContact CD1-CD2 3.87Å; L268-F280 HydrophobicContact CD1-CE1 4.03Å; L268-F280 HydrophobicContact CD1-CE2 4.03Å; L268-F280 HydrophobicContact CD1-CG 3.8Å; L268-F280 HydrophobicContact CD1-CZ 4.09Å; L268-F280 HydrophobicContact CD2-CD1 4.03Å; L268-F280 HydrophobicContact CD2-CE1 3.76Å; L268-F280 HydrophobicContact CD2-CZ 4.3Å; L268-V302 HydrophobicContact CD2-CB 4.45Å; L268-V302 HydrophobicContact CD2-CG2 3.76Å; L268-L305 HydrophobicContact CD2-CD1 4.24Å; L268-L305 HydrophobicContact CG-CD1 4.36Å
269	E	98.8	Very high	98.7	Very high	59 Å²	59	47.1 Å²	47.1	28%	0.276	25%	0.247	S	C	.	.	H	α-helix	trans	-58.9	-41.3	-179.9	-179.9	163.8	-147	0	0	111.6	I265 L272 Q273 L305 K308 Y309	I265-E269 WeakPolarHBondContact O-CB 3.06Å; I265-E269 PolarHBondContact O-N 2.91Å; E269-L272 PolarHBondContact O-N 2.74Å; E269-Q273 WeakPolarHBondContact O-CG 3.27Å; E269-Q273 PolarHBondContact O-N 3.4Å; E269-L305 HydrophobicContact CB-CD1 3.91Å; E269-L305 HydrophobicContact CB-CD2 3.96Å; E269-L305 HydrophobicContact CG-CD2 3.82Å; E269-K308 IonicContact OE1-NZ 3.02Å; E269-K308 PolarHBondContact OE1-NZ 2.93Å; E269-Y309 HydrophobicContact CG-CE2 3.95Å; E269-Y309 PolarHBondContact OE1-OH 3.33Å
270	K	98.9	Very high	98.7	Very high	157 Å²	157	44 Å²	44	68%	0.683	23%	0.231	S	C	*	.	H	α-helix	trans	-61.3	-45.1	175.6	-177.3	-179	177.7	-175.7	0	111.9	P266 A267 L268 Q273	P266-K270 WeakPolarHBondContact O-CB 3.35Å; P266-K270 PolarHBondContact O-N 2.95Å; A267-K270 PolarHBondContact O-N 3.29Å; L268-K270 VanDerWaalsContact C-N 3.29Å; L268-K270 PolarHBondContact O-N 3.12Å; K270-Q273 WeakPolarHBondContact O-CB 3.37Å; K270-Q273 PolarHBondContact O-N 3.09Å
271	A	98.8	Very high	98.7	Very high	20 Å²	20	43.8 Å²	43.8	17%	0.165	23%	0.229	C	C	.	.	H	α-helix	trans	-67.1	-38.4	-179.4	0	0	0	0	0	112.2	I224 V260 A267 L268 Q273 D274	I224-A271 HydrophobicContact CD1-CB 3.58Å; I224-A271 HydrophobicContact CG1-CB 4.48Å; V260-A271 HydrophobicContact CG1-CB 3.71Å; A267-A271 PolarHBondContact O-N 3.24Å; L268-A271 PolarHBondContact O-N 3.14Å; L268-A271 VanDerWaalsContact O-N 3.14Å; A271-Q273 PolarHBondContact O-N 3.11Å; A271-Q273 VanDerWaalsContact O-N 3.14Å; A271-D274 PolarHBondContact O-N 2.83Å
272	L	98.8	Very high	98.8	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-66.3	-11.8	178.5	-67.2	173	0	0	0	114.3	I224 L268 E269 D274 V277 L305 Y309 V311	I224-L272 HydrophobicContact CD1-CD2 3.9Å; I224-L272 HydrophobicContact CD1-CG 4.34Å; L268-L272 HydrophobicContact CD1-CD1 3.86Å; L268-L272 HydrophobicContact CD1-CD2 4.32Å; L268-L272 HydrophobicContact CD1-CG 3.92Å; L268-L272 HydrophobicContact CD2-CD1 4.41Å; L268-L272 HydrophobicContact CG-CD1 3.75Å; L268-L272 HydrophobicContact CG-CG 4.24Å; L268-L272 VanDerWaalsContact O-CG 3.26Å; L268-L272 WeakPolarHBondContact O-CG 3.42Å; L268-L272 PolarHBondContact O-N 3.24Å; E269-L272 PolarHBondContact O-N 2.74Å; L272-D274 VanDerWaalsContact C-N 3.26Å; L272-D274 PolarHBondContact O-N 3.21Å; L272-V277 HydrophobicContact CD2-CG1 4.13Å; L272-L305 HydrophobicContact CD1-CB 3.68Å; L272-Y309 HydrophobicContact CB-CD2 3.74Å; L272-Y309 HydrophobicContact CB-CE2 4.36Å; L272-Y309 HydrophobicContact CB-CG 3.9Å; L272-Y309 HydrophobicContact CD1-CD2 4.28Å; L272-Y309 WeakPolarHBondContact O-CD1 3.28Å; L272-V311 HydrophobicContact CD2-CB 3.94Å; L272-V311 HydrophobicContact CD2-CG1 3.66Å; L272-V311 HydrophobicContact CD2-CG2 3.84Å
273	Q	98.6	Very high	98.8	Very high	109 Å²	109	40.9 Å²	40.9	51%	0.509	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-22	175.5	-69.5	170.8	12.5	0	0	113.3	E269 K270 A271 Q275 Y309	E269-Q273 WeakPolarHBondContact O-CG 3.27Å; E269-Q273 PolarHBondContact O-N 3.4Å; K270-Q273 WeakPolarHBondContact O-CB 3.37Å; K270-Q273 PolarHBondContact O-N 3.09Å; A271-Q273 PolarHBondContact O-N 3.11Å; A271-Q273 VanDerWaalsContact O-N 3.14Å; Q273-Q275 PolarHBondContact O-N 2.55Å; Q273-Q275 PolarHBondContact O-NE2 3.19Å; Q273-Y309 HydrophobicContact CG-CE1 3.8Å
274	D	98.6	Very high	98.8	Very high	45 Å²	45	38.8 Å²	38.8	24%	0.241	20%	0.201	C	C	.	.	S	Bend	trans	-68.8	118	172.8	-177.6	-10.4	0	0	0	110.2	K222 A271 L272 N276 V277	K222-D274 WeakPolarHBondContact CD-OD2 3.49Å; K222-D274 VanDerWaalsContact CE-OD2 3.31Å; K222-D274 WeakPolarHBondContact CE-OD2 3.49Å; K222-D274 IonicContact NZ-OD2 2.73Å; K222-D274 PolarHBondContact NZ-OD2 2.78Å; A271-D274 PolarHBondContact O-N 2.83Å; L272-D274 VanDerWaalsContact C-N 3.26Å; L272-D274 PolarHBondContact O-N 3.21Å; D274-N276 PolarHBondContact O-N 3.44Å; D274-N276 VanDerWaalsContact O-N 3.07Å; D274-N276 WeakPolarHBondContact OD1-CB 3.34Å; D274-N276 PolarHBondContact OD1-N 2.8Å; D274-N276 PolarHBondContact OD1-ND2 3.49Å; D274-V277 HydrophobicContact CB-CG2 3.97Å; D274-V277 WeakPolarHBondContact O-CB 3.49Å; D274-V277 WeakPolarHBondContact O-CG2 3.46Å; D274-V277 PolarHBondContact O-N 3.33Å
275	Q	97.9	Very high	98.8	Very high	130 Å²	130	36.1 Å²	36.1	61%	0.607	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-18.2	-177.6	-60.6	-57.6	-52.4	0	0	113.5	K214 Q273 V277	K214-Q275 WeakPolarHBondContact CE-O 3.23Å; Q273-Q275 PolarHBondContact O-N 2.55Å; Q273-Q275 PolarHBondContact O-NE2 3.19Å; Q275-V277 VanDerWaalsContact C-N 3.31Å
276	N	98.8	Very high	98.8	Very high	47 Å²	47	34.5 Å²	34.5	25%	0.251	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-5.3	177.7	-56.6	-64	0	0	0	113.6	V216 K220 A221 K222 D274 A278	V216-N276 HydrophobicContact CG1-CB 4.05Å; K220-N276 WeakPolarHBondContact O-CB 3.44Å; A221-N276 WeakPolarHBondContact CA-O 3.36Å; K222-N276 PolarHBondContact N-O 3.26Å; D274-N276 PolarHBondContact O-N 3.44Å; D274-N276 VanDerWaalsContact O-N 3.07Å; D274-N276 WeakPolarHBondContact OD1-CB 3.34Å; D274-N276 PolarHBondContact OD1-N 2.8Å; D274-N276 PolarHBondContact OD1-ND2 3.49Å; N276-A278 PolarHBondContact O-N 3.24Å
277	V	98.9	Very high	98.6	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	120.5	177.3	179.5	0	0	0	0	109.4	K214 K222 I224 L272 D274 Q275 V311	K214-V277 PolarHBondContact NZ-O 3.43Å; K222-V277 HydrophobicContact CB-CG2 4.36Å; I224-V277 HydrophobicContact CD1-CB 4.47Å; I224-V277 HydrophobicContact CD1-CG1 3.69Å; I224-V277 HydrophobicContact CD1-CG2 3.94Å; I224-V277 HydrophobicContact CG1-CG1 3.96Å; I224-V277 HydrophobicContact CG1-CG2 4.31Å; L272-V277 HydrophobicContact CD2-CG1 4.13Å; D274-V277 HydrophobicContact CB-CG2 3.97Å; D274-V277 WeakPolarHBondContact O-CB 3.49Å; D274-V277 WeakPolarHBondContact O-CG2 3.46Å; D274-V277 PolarHBondContact O-N 3.33Å; Q275-V277 VanDerWaalsContact C-N 3.31Å; V277-V311 HydrophobicContact CB-CG2 4.11Å; V277-V311 HydrophobicContact CG1-CG1 3.76Å; V277-V311 HydrophobicContact CG1-CG2 3.95Å
278	A	98.9	Very high	98.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-45.6	177.2	0	0	0	0	0	111.5	A206 A210 A221 K222 N276 L312	A206-A278 HydrophobicContact CB-CB 4.44Å; A210-A278 HydrophobicContact CB-CB 3.45Å; A210-A278 VanDerWaalsContact CB-CB 3.45Å; A221-A278 HydrophobicContact CB-CB 4.18Å; K222-A278 WeakPolarHBondContact O-CB 3.37Å; K222-A278 PolarHBondContact O-N 3.02Å; N276-A278 PolarHBondContact O-N 3.24Å; A278-L312 PolarHBondContact O-N 3.33Å
279	A	98.9	Very high	98	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	159.3	-174.9	0	0	0	0	0	113.3	A206 I223 I224 V311 L312 I314	A206-A279 HydrophobicContact CB-CB 3.66Å; I223-A279 WeakPolarHBondContact CA-O 3.31Å; I223-A279 HydrophobicContact CG2-CB 4.26Å; I224-A279 PolarHBondContact N-O 3.28Å; A279-V311 VanDerWaalsContact CA-CG1 3.47Å; A279-L312 CarbonylContact C-O 3.46Å; A279-L312 WeakPolarHBondContact CA-O 3.21Å; A279-L312 HydrophobicContact CB-CB 4.04Å; A279-L312 VanDerWaalsContact CB-O 3.31Å; A279-L312 WeakPolarHBondContact CB-O 3.27Å; A279-I314 HydrophobicContact CB-CD1 3.65Å; A279-I314 HydrophobicContact CB-CG1 4.13Å
280	F	98.9	Very high	97.8	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	120.3	158.8	175	-129.4	0	0	0	108.8	I224 V260 L268 V282 V302 L312 I314	I224-F280 HydrophobicContact CB-CD2 3.9Å; I224-F280 HydrophobicContact CG2-CD2 3.72Å; I224-F280 HydrophobicContact CG2-CE2 4.1Å; I224-F280 WeakPolarHBondContact O-CA 3.3Å; I224-F280 WeakPolarHBondContact O-CD2 3.36Å; V260-F280 HydrophobicContact CG2-CE2 4.18Å; L268-F280 HydrophobicContact CD1-CB 4.4Å; L268-F280 HydrophobicContact CD1-CD1 3.89Å; L268-F280 HydrophobicContact CD1-CD2 3.87Å; L268-F280 HydrophobicContact CD1-CE1 4.03Å; L268-F280 HydrophobicContact CD1-CE2 4.03Å; L268-F280 HydrophobicContact CD1-CG 3.8Å; L268-F280 HydrophobicContact CD1-CZ 4.09Å; L268-F280 HydrophobicContact CD2-CD1 4.03Å; L268-F280 HydrophobicContact CD2-CE1 3.76Å; L268-F280 HydrophobicContact CD2-CZ 4.3Å; F280-V282 HydrophobicContact CD1-CB 4.31Å; F280-V282 HydrophobicContact CD1-CG1 3.95Å; F280-V282 HydrophobicContact CE1-CB 3.64Å; F280-V282 HydrophobicContact CE1-CG1 3.43Å; F280-V282 VanDerWaalsContact CE1-CG1 3.43Å; F280-V282 HydrophobicContact CE1-CG2 4.14Å; F280-V282 HydrophobicContact CE2-CB 4.05Å; F280-V282 HydrophobicContact CE2-CG2 4.48Å; F280-V282 HydrophobicContact CZ-CB 3.49Å; F280-V282 VanDerWaalsContact CZ-CB 3.49Å; F280-V282 HydrophobicContact CZ-CG1 3.86Å; F280-V282 HydrophobicContact CZ-CG2 3.72Å; F280-V302 HydrophobicContact CD1-CG1 3.65Å; F280-V302 HydrophobicContact CD1-CG2 4.46Å; F280-V302 HydrophobicContact CE1-CG1 3.8Å; F280-V302 HydrophobicContact CE1-CG2 3.83Å; F280-L312 PolarHBondContact N-O 2.99Å; F280-I314 PolarHBondContact O-N 3.01Å
281	M	98.9	Very high	97.7	Very high	5 Å²	5	20.9 Å²	20.9	3%	0.025	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	122.4	177	-178.7	169.1	163.5	0	0	110.3	I223 I224 F225 W231 I314 D316 I342	I223-M281 HydrophobicContact CG2-CB 4.35Å; I224-M281 PolarHBondContact O-N 3.27Å; F225-M281 HydrophobicContact CD1-CB 3.98Å; F225-M281 HydrophobicContact CD1-CG 4.27Å; F225-M281 HydrophobicContact CE1-CB 3.79Å; F225-M281 HydrophobicContact CE1-CG 3.95Å; F225-M281 HydrophobicContact CE1-SD 3.66Å; F225-M281 HydrophobicContact CZ-CB 4.42Å; F225-M281 HydrophobicContact CZ-SD 4.36Å; W231-M281 HydrophobicContact CB-CE 3.57Å; W231-M281 HydrophobicContact CD2-CE 4.01Å; W231-M281 HydrophobicContact CE3-CE 4.34Å; W231-M281 HydrophobicContact CG-CE 3.75Å; M281-I314 WeakPolarHBondContact CA-O 3.33Å; M281-I314 HydrophobicContact CB-CB 4.01Å; M281-I314 HydrophobicContact CB-CD1 4.25Å; M281-I314 HydrophobicContact CB-CG2 4.38Å; M281-I314 HydrophobicContact CG-CB 4.06Å; M281-I314 HydrophobicContact CG-CG2 3.89Å; M281-I314 HydrophobicContact SD-CG2 4.13Å; M281-D316 HydrophobicContact CE-CB 4.1Å; M281-I342 HydrophobicContact CE-CD1 3.55Å; M281-I342 HydrophobicContact SD-CD1 4.15Å
282	V	98.9	Very high	97.7	Very high	5 Å²	5	22.2 Å²	22.2	3%	0.03	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	142.9	-174.6	68.6	0	0	0	0	112	A226 F262 F280 Y298 I314 D316	A226-V282 HydrophobicContact CB-CG2 4.01Å; F262-V282 HydrophobicContact CD2-CG2 3.96Å; F262-V282 HydrophobicContact CE2-CG2 3.69Å; F280-V282 HydrophobicContact CD1-CB 4.31Å; F280-V282 HydrophobicContact CD1-CG1 3.95Å; F280-V282 HydrophobicContact CE1-CB 3.64Å; F280-V282 HydrophobicContact CE1-CG1 3.43Å; F280-V282 VanDerWaalsContact CE1-CG1 3.43Å; F280-V282 HydrophobicContact CE1-CG2 4.14Å; F280-V282 HydrophobicContact CE2-CB 4.05Å; F280-V282 HydrophobicContact CE2-CG2 4.48Å; F280-V282 HydrophobicContact CZ-CB 3.49Å; F280-V282 VanDerWaalsContact CZ-CB 3.49Å; F280-V282 HydrophobicContact CZ-CG1 3.86Å; F280-V282 HydrophobicContact CZ-CG2 3.72Å; V282-Y298 HydrophobicContact CG2-CE1 4.49Å; V282-I314 PolarHBondContact N-O 3.25Å; V282-D316 PolarHBondContact O-N 3.07Å
283	E	98.9	Very high	97.7	Very high	10 Å²	10	24.2 Å²	24.2	5%	0.047	13%	0.127	C	C	.	.			trans	-76.4	133.9	168.4	-64.6	165.7	-106	0	0	109.5	F230 I285 Q286 G287 D316	F230-E283 PolarHBondContact N-OE1 3.23Å; E283-I285 PolarHBondContact O-N 2.91Å; E283-Q286 HydrophobicContact CB-CG 4.41Å; E283-Q286 WeakPolarHBondContact OE2-CA 3.12Å; E283-G287 PolarHBondContact OE2-N 3.48Å; E283-D316 HydrophobicContact CG-CB 4.03Å
284	P	98.8	Very high	97.7	Very high	3 Å²	3	19.8 Å²	19.8	2%	0.019	11%	0.107	C	C	.	.	S	Bend	trans	-58.5	-29.3	173.5	-29.1	38	0	0	0	114.1	P294 L299 D316 E317 A330 V331	P284-P294 WeakPolarHBondContact O-CD 3.38Å; P284-P294 VanDerWaalsContact O-CG 3.32Å; P284-P294 WeakPolarHBondContact O-CG 3.22Å; P284-L299 HydrophobicContact CB-CD1 3.84Å; P284-D316 WeakPolarHBondContact CD-O 3.35Å; P284-E317 HydrophobicContact CG-CG 4.04Å; P284-A330 HydrophobicContact CB-CB 3.63Å; P284-A330 HydrophobicContact CG-CB 4.12Å; P284-V331 HydrophobicContact CG-CG1 3.87Å
285	I	98.8	Very high	97.7	Very high	4 Å²	4	22.9 Å²	22.9	2%	0.021	12%	0.124	C	C	.	.	S	Bend	trans	-142.1	122.4	170.9	-60.9	174.7	0	0	0	105.5	E283 G287 V291 V292 V293 T320 T325 K427 L430	E283-I285 PolarHBondContact O-N 2.91Å; I285-G287 PolarHBondContact O-N 2.73Å; I285-G287 VanDerWaalsContact O-N 3.12Å; I285-V291 HydrophobicContact CG2-CG1 3.97Å; I285-V292 WeakPolarHBondContact CG2-O 3.31Å; I285-V293 HydrophobicContact CD1-CG2 4.31Å; I285-V293 HydrophobicContact CG2-CG2 4.1Å; I285-T320 HydrophobicContact CB-CG2 3.82Å; I285-T320 HydrophobicContact CG1-CG2 4.49Å; I285-T320 WeakPolarHBondContact O-CG2 3.44Å; I285-T325 HydrophobicContact CD1-CG2 3.83Å; I285-K427 HydrophobicContact CD1-CB 3.85Å; I285-K427 HydrophobicContact CD1-CD 4.19Å; I285-K427 HydrophobicContact CD1-CG 4.05Å; I285-L430 HydrophobicContact CG2-CD2 4.25Å
286	Q	98.4	Very high	97.7	Very high	8 Å²	8	25.9 Å²	25.9	4%	0.037	14%	0.138	C	C	.	.	B	Isolated β-bridge	trans	-71.5	111.1	178.9	-67.6	-176.2	-41.6	0	0	110.2	E227 F262 E283 A289 V291 V292	E227-Q286 PolarHBondContact O-NE2 3.17Å; F262-Q286 HydrophobicContact CD1-CG 4.08Å; F262-Q286 HydrophobicContact CD2-CG 4.03Å; F262-Q286 HydrophobicContact CE1-CG 4.02Å; F262-Q286 HydrophobicContact CE2-CG 3.96Å; F262-Q286 VanDerWaalsContact CG-CD 3.5Å; F262-Q286 HydrophobicContact CG-CG 4.08Å; F262-Q286 HydrophobicContact CZ-CG 3.96Å; E283-Q286 HydrophobicContact CB-CG 4.41Å; E283-Q286 WeakPolarHBondContact OE2-CA 3.12Å; Q286-A289 HydrophobicContact CB-CB 3.94Å; Q286-V291 CarbonylContact O-C 3.59Å; Q286-V291 WeakPolarHBondContact O-CA 3.4Å; Q286-V291 PolarHBondContact O-N 3.4Å; Q286-V292 HydrophobicContact CB-CB 4.25Å; Q286-V292 PolarHBondContact N-O 3.42Å; Q286-V292 VanDerWaalsContact N-O 3.14Å; Q286-V292 PolarHBondContact O-N 3.35Å
287	G	95.3	Very high	97.7	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.01	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-48	-169.7	0	0	0	0	0	113.5	E283 I285 A289 G290 V291 Q319	E283-G287 PolarHBondContact OE2-N 3.48Å; I285-G287 PolarHBondContact O-N 2.73Å; I285-G287 VanDerWaalsContact O-N 3.12Å; G287-A289 PolarHBondContact O-N 3.23Å; G287-G290 PolarHBondContact O-N 3.27Å; G287-G290 VanDerWaalsContact O-N 3.1Å; G287-V291 PolarHBondContact O-N 2.77Å; G287-Q319 VanDerWaalsContact CA-OE1 3.23Å
288	E	93.3	Very high	97.7	Very high	30 Å²	30	25 Å²	25	14%	0.14	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-35.3	179.8	-70	-49.4	125.9	0	0	112.6	F230 G290 Q319 T460 H461 R466	F230-E288 HydrophobicContact CB-CB 3.67Å; F230-E288 HydrophobicContact CB-CG 3.71Å; F230-E288 HydrophobicContact CD1-CB 4.28Å; F230-E288 HydrophobicContact CD1-CG 3.34Å; F230-E288 HydrophobicContact CD2-CB 4.45Å; F230-E288 HydrophobicContact CD2-CG 4.1Å; F230-E288 HydrophobicContact CE1-CG 3.93Å; F230-E288 HydrophobicContact CG-CB 3.89Å; F230-E288 HydrophobicContact CG-CG 3.43Å; F230-E288 VanDerWaalsContact CG-CG 3.43Å; E288-G290 PolarHBondContact O-N 2.87Å; E288-Q319 PolarHBondContact OE1-NE2 2.7Å; E288-T460 PolarHBondContact O-OG1 2.98Å; E288-H461 PolarHBondContact O-CE1 2.81Å; E288-H461 PolarHBondContact O-ND1 3.15Å; E288-R466 IonicContact OE1-CZ 3.43Å; E288-R466 IonicContact OE1-NH1 3.5Å; E288-R466 PolarHBondContact OE1-NH1 2.88Å; E288-R466 IonicContact OE1-NH2 3.55Å; E288-R466 IonicContact OE2-CZ 2.74Å; E288-R466 IonicContact OE2-NH1 3.58Å; E288-R466 PolarHBondContact OE2-NH1 3.02Å; E288-R466 VanDerWaalsContact OE2-NH1 3.11Å; E288-R466 IonicContact OE2-NH2 3.53Å; E288-R466 PolarHBondContact OE2-NH2 3.42Å
289	A	92.8	Very high	97.7	Very high	20 Å²	20	25.3 Å²	25.3	17%	0.165	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	3.8	171.4	0	0	0	0	0	113.9	Q286 G287 V292	Q286-A289 HydrophobicContact CB-CB 3.94Å; G287-A289 PolarHBondContact O-N 3.23Å; A289-V292 HydrophobicContact CB-CG2 4.1Å
290	G	93.9	Very high	97.6	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	98.4	39	174.1	0	0	0	0	0	113.8	G287 E288 R425	G287-G290 PolarHBondContact O-N 3.27Å; G287-G290 VanDerWaalsContact O-N 3.1Å; E288-G290 PolarHBondContact O-N 2.87Å; G290-R425 PolarHBondContact O-NE 3.43Å; G290-R425 PolarHBondContact O-NH2 2.76Å
291	V	97.4	Very high	97.6	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.171	C	C	.	.			trans	59.2	56	177.4	-168.5	0	0	0	0	110.9	I285 Q286 G287 V293 R425 L430 A432 R466	I285-V291 HydrophobicContact CG2-CG1 3.97Å; Q286-V291 CarbonylContact O-C 3.59Å; Q286-V291 WeakPolarHBondContact O-CA 3.4Å; Q286-V291 PolarHBondContact O-N 3.4Å; G287-V291 PolarHBondContact O-N 2.77Å; V291-V293 PolarHBondContact O-N 2.68Å; V291-R425 WeakPolarHBondContact O-CD 3.27Å; V291-R425 WeakPolarHBondContact O-CG 3.23Å; V291-R425 PolarHBondContact O-NE 3.26Å; V291-L430 HydrophobicContact CG1-CD2 4.35Å; V291-L430 HydrophobicContact CG1-CG 3.84Å; V291-L430 HydrophobicContact CG2-CD1 4Å; V291-L430 HydrophobicContact CG2-CG 4.12Å; V291-A432 HydrophobicContact CB-CB 3.83Å; V291-A432 HydrophobicContact CG2-CB 3.83Å; V291-R466 HydrophobicContact CG2-CG 4.3Å
292	V	98	Very high	97.6	Very high	49 Å²	49	31.4 Å²	31.4	30%	0.297	17%	0.17	S	C	.	.	B	Isolated β-bridge	trans	-80.4	107	176.6	-173.8	0	0	0	0	108.3	F262 I285 Q286 A289	F262-V292 HydrophobicContact CD1-CG1 3.99Å; F262-V292 HydrophobicContact CE1-CB 4.37Å; F262-V292 HydrophobicContact CE1-CG1 4Å; I285-V292 WeakPolarHBondContact CG2-O 3.31Å; Q286-V292 HydrophobicContact CB-CB 4.25Å; Q286-V292 PolarHBondContact N-O 3.42Å; Q286-V292 VanDerWaalsContact N-O 3.14Å; Q286-V292 PolarHBondContact O-N 3.35Å; A289-V292 HydrophobicContact CB-CG2 4.1Å
293	V	98.4	Very high	97.6	Very high	43 Å²	43	33 Å²	33	26%	0.261	18%	0.175	S	C	.	.	P	Polyproline II helix	trans	-86	123.6	177.6	-173.4	0	0	0	0	107.9	I285 V291 K427	I285-V293 HydrophobicContact CD1-CG2 4.31Å; I285-V293 HydrophobicContact CG2-CG2 4.1Å; V291-V293 PolarHBondContact O-N 2.68Å; V293-K427 HydrophobicContact CG1-CG 4.28Å
294	P	98.4	Very high	97.6	Very high	16 Å²	16	37 Å²	37	10%	0.104	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-70.9	169	178.4	31.7	-35.5	0	0	0	111.3	F262 N263 P284 Y298	F262-P294 HydrophobicContact CE1-CB 3.94Å; F262-P294 HydrophobicContact CE1-CG 4.42Å; F262-P294 HydrophobicContact CZ-CB 3.81Å; F262-P294 HydrophobicContact CZ-CG 3.97Å; N263-P294 HydrophobicContact CB-CB 4.18Å; N263-P294 WeakPolarHBondContact OD1-CB 3.32Å; P284-P294 WeakPolarHBondContact O-CD 3.38Å; P284-P294 VanDerWaalsContact O-CG 3.32Å; P284-P294 WeakPolarHBondContact O-CG 3.22Å; P294-Y298 HydrophobicContact CB-CD1 3.59Å; P294-Y298 HydrophobicContact CB-CE1 4.36Å; P294-Y298 HydrophobicContact CB-CG 3.84Å; P294-Y298 HydrophobicContact CG-CD1 3.9Å; P294-Y298 HydrophobicContact CG-CG 4.48Å
295	D	98.4	Very high	97.6	Very high	109 Å²	109	37.4 Å²	37.4	58%	0.583	20%	0.196	S	C	*	.	P	Polyproline II helix	trans	-63.6	151.5	174.7	-68.5	-35.1	0	0	0	111.1	N263 G297 Y298	N263-D295 PolarHBondContact ND2-N 3.09Å; N263-D295 PolarHBondContact ND2-OD2 3.08Å; N263-D295 PolarHBondContact OD1-N 3.01Å; D295-G297 PolarHBondContact O-N 3.06Å; D295-Y298 VanDerWaalsContact O-CB 3.23Å; D295-Y298 WeakPolarHBondContact O-CB 3.4Å; D295-Y298 PolarHBondContact O-N 3.43Å; D295-Y298 VanDerWaalsContact O-N 3.11Å
296	Q	98	Very high	97.7	Very high	194 Å²	194	37.2 Å²	37.2	91%	0.907	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	128.9	177.6	-176.2	158.4	11.7	0	0	110.9
297	G	98.4	Very high	97.7	Very high	23 Å²	23	41.3 Å²	41.3	24%	0.237	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.4	-4.2	-177.7	0	0	0	0	0	113.7	D295 L299 T300 K301 E334	D295-G297 PolarHBondContact O-N 3.06Å; G297-L299 PolarHBondContact O-N 2.79Å; G297-T300 WeakPolarHBondContact O-CB 3.49Å; G297-T300 PolarHBondContact O-N 2.79Å; G297-K301 WeakPolarHBondContact O-CG 3.34Å; G297-K301 PolarHBondContact O-N 2.89Å; G297-E334 VanDerWaalsContact C-OE2 3.26Å; G297-E334 WeakPolarHBondContact CA-OE2 3.32Å; G297-E334 PolarHBondContact N-OE1 2.75Å
298	Y	98.9	Very high	97.8	Very high	5 Å²	5	47.6 Å²	47.6	2%	0.02	25%	0.248	C	C	.	.	H	α-helix	trans	-57.3	-50.2	177.5	173.4	-108.6	0	0	0	111.6	F262 N263 I265 V282 P294 D295 T300 K301 V302	F262-Y298 HydrophobicContact CD2-CE1 4.39Å; F262-Y298 AromaticContact CE2-CE1 3.86Å; F262-Y298 HydrophobicContact CE2-CE1 3.86Å; F262-Y298 HydrophobicContact CZ-CE1 4.42Å; N263-Y298 VanDerWaalsContact CA-CE2 3.44Å; I265-Y298 HydrophobicContact CD1-CD2 3.47Å; I265-Y298 VanDerWaalsContact CD1-CD2 3.47Å; I265-Y298 HydrophobicContact CD1-CE2 3.63Å; I265-Y298 HydrophobicContact CG1-CD2 4Å; I265-Y298 HydrophobicContact CG1-CE2 4.38Å; V282-Y298 HydrophobicContact CG2-CE1 4.49Å; P294-Y298 HydrophobicContact CB-CD1 3.59Å; P294-Y298 HydrophobicContact CB-CE1 4.36Å; P294-Y298 HydrophobicContact CB-CG 3.84Å; P294-Y298 HydrophobicContact CG-CD1 3.9Å; P294-Y298 HydrophobicContact CG-CG 4.48Å; D295-Y298 VanDerWaalsContact O-CB 3.23Å; D295-Y298 WeakPolarHBondContact O-CB 3.4Å; D295-Y298 PolarHBondContact O-N 3.43Å; D295-Y298 VanDerWaalsContact O-N 3.11Å; Y298-T300 VanDerWaalsContact C-N 3.31Å; Y298-T300 PolarHBondContact O-N 3Å; Y298-K301 PolarHBondContact O-N 3.32Å; Y298-K301 VanDerWaalsContact O-N 3.14Å; Y298-V302 HydrophobicContact CD1-CG2 4.25Å; Y298-V302 HydrophobicContact CD2-CG2 4.39Å; Y298-V302 HydrophobicContact CE1-CG2 3.85Å; Y298-V302 HydrophobicContact CE2-CG2 3.98Å; Y298-V302 WeakPolarHBondContact O-CG2 3.35Å; Y298-V302 PolarHBondContact O-N 3.08Å
299	L	98.8	Very high	98.1	Very high	7 Å²	7	48 Å²	48	4%	0.037	25%	0.249	C	C	.	.	H	α-helix	trans	-69.2	-32.4	-177.6	-58.9	176.7	0	0	0	111.9	P284 G297 V302 R303 W313 V331 E334 V336	P284-L299 HydrophobicContact CB-CD1 3.84Å; G297-L299 PolarHBondContact O-N 2.79Å; L299-V302 PolarHBondContact O-N 3.38Å; L299-R303 PolarHBondContact O-N 3Å; L299-W313 HydrophobicContact CB-CH2 4.27Å; L299-W313 HydrophobicContact CB-CZ2 4.47Å; L299-W313 HydrophobicContact CD2-CZ2 4.15Å; L299-V331 HydrophobicContact CD1-CG1 4.38Å; L299-E334 PolarHBondContact N-OE2 3.38Å; L299-V336 HydrophobicContact CB-CG2 4.09Å
300	T	98.9	Very high	98.4	Very high	44 Å²	44	51.5 Å²	51.5	27%	0.27	26%	0.264	S	S	.	.	H	α-helix	trans	-58	-48.5	170	-53.1	0	0	0	0	110.8	G297 Y298 R303 E304 E334	G297-T300 WeakPolarHBondContact O-CB 3.49Å; G297-T300 PolarHBondContact O-N 2.79Å; Y298-T300 VanDerWaalsContact C-N 3.31Å; Y298-T300 PolarHBondContact O-N 3Å; T300-R303 PolarHBondContact O-N 3.37Å; T300-E304 WeakPolarHBondContact O-CG 3.48Å; T300-E304 PolarHBondContact O-N 3.22Å; T300-E334 WeakPolarHBondContact CB-OE2 3.13Å; T300-E334 PolarHBondContact N-OE2 2.98Å; T300-E334 PolarHBondContact OG1-OE2 2.61Å
301	K	98.9	Very high	98.6	Very high	89 Å²	89	51.7 Å²	51.7	39%	0.387	27%	0.265	S	S	.	.	H	α-helix	trans	-68.2	-36.9	177	-66.8	-57.1	175.6	-156	0	113.2	I265 G297 Y298 R303 E304 L305	I265-K301 HydrophobicContact CD1-CB 3.53Å; I265-K301 HydrophobicContact CG1-CB 3.95Å; I265-K301 HydrophobicContact CG1-CG 4.5Å; I265-K301 HydrophobicContact CG2-CB 4.32Å; G297-K301 WeakPolarHBondContact O-CG 3.34Å; G297-K301 PolarHBondContact O-N 2.89Å; Y298-K301 PolarHBondContact O-N 3.32Å; Y298-K301 VanDerWaalsContact O-N 3.14Å; K301-R303 VanDerWaalsContact C-N 3.33Å; K301-R303 PolarHBondContact O-N 2.97Å; K301-E304 VanDerWaalsContact CD-OE2 3.28Å; K301-E304 WeakPolarHBondContact CD-OE2 3.4Å; K301-E304 IonicContact NZ-OE1 2.79Å; K301-E304 PolarHBondContact NZ-OE1 2.87Å; K301-E304 IonicContact NZ-OE2 2.65Å; K301-E304 PolarHBondContact NZ-OE2 3.13Å; K301-E304 PolarHBondContact O-N 3.28Å; K301-L305 WeakPolarHBondContact O-CB 3.39Å; K301-L305 VanDerWaalsContact O-CG 3.27Å; K301-L305 WeakPolarHBondContact O-CG 3.45Å; K301-L305 PolarHBondContact O-N 3.06Å
302	V	98.9	Very high	98.7	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-56.4	-49	170.8	169.7	0	0	0	0	110.6	I265 L268 F280 Y298 L299 L305 C306 W313	I265-V302 HydrophobicContact CD1-CG2 4.44Å; L268-V302 HydrophobicContact CD2-CB 4.45Å; L268-V302 HydrophobicContact CD2-CG2 3.76Å; F280-V302 HydrophobicContact CD1-CG1 3.65Å; F280-V302 HydrophobicContact CD1-CG2 4.46Å; F280-V302 HydrophobicContact CE1-CG1 3.8Å; F280-V302 HydrophobicContact CE1-CG2 3.83Å; Y298-V302 HydrophobicContact CD1-CG2 4.25Å; Y298-V302 HydrophobicContact CD2-CG2 4.39Å; Y298-V302 HydrophobicContact CE1-CG2 3.85Å; Y298-V302 HydrophobicContact CE2-CG2 3.98Å; Y298-V302 WeakPolarHBondContact O-CG2 3.35Å; Y298-V302 PolarHBondContact O-N 3.08Å; L299-V302 PolarHBondContact O-N 3.38Å; V302-L305 PolarHBondContact O-N 3.35Å; V302-C306 WeakPolarHBondContact O-CB 3.47Å; V302-C306 PolarHBondContact O-N 2.81Å; V302-C306 PolarHBondContact O-SG 3.21Å; V302-W313 HydrophobicContact CG1-CD2 3.88Å; V302-W313 HydrophobicContact CG1-CG 3.91Å
303	R	98.8	Very high	98.7	Very high	37 Å²	37	49.8 Å²	49.8	14%	0.14	25%	0.253	C	S	.	.	H	α-helix	trans	-59.9	-49.4	178.3	178.2	66.4	-75.8	173.3	-1.1	111.8	L299 T300 K301 L305 T307 W313 V336 R337 D339	L299-R303 PolarHBondContact O-N 3Å; T300-R303 PolarHBondContact O-N 3.37Å; K301-R303 VanDerWaalsContact C-N 3.33Å; K301-R303 PolarHBondContact O-N 2.97Å; R303-L305 PolarHBondContact O-N 2.73Å; R303-T307 PolarHBondContact NE-OG1 3.35Å; R303-T307 PolarHBondContact NH2-OG1 3.4Å; R303-T307 PolarHBondContact O-N 3.48Å; R303-T307 VanDerWaalsContact O-N 3.1Å; R303-T307 PolarHBondContact O-OG1 3.1Å; R303-T307 VanDerWaalsContact O-OG1 3.06Å; R303-W313 HydrophobicContact CB-CE3 3.98Å; R303-W313 HydrophobicContact CB-CZ3 3.88Å; R303-W313 HydrophobicContact CG-CE3 4.48Å; R303-W313 HydrophobicContact CG-CZ3 4.43Å; R303-V336 HydrophobicContact CB-CB 4.18Å; R303-V336 HydrophobicContact CB-CG1 3.98Å; R303-V336 HydrophobicContact CG-CB 4.29Å; R303-V336 HydrophobicContact CG-CG1 4.15Å; R303-R337 VanDerWaalsContact CD-O 3.26Å; R303-R337 WeakPolarHBondContact CD-O 3.4Å; R303-R337 PolarHBondContact NH1-O 2.67Å; R303-D339 IonicContact CZ-OD1 3.55Å; R303-D339 IonicContact CZ-OD2 3.81Å; R303-D339 IonicContact NH1-OD1 3.06Å; R303-D339 PolarHBondContact NH1-OD1 3.06Å; R303-D339 IonicContact NH1-OD2 3.29Å; R303-D339 PolarHBondContact NH1-OD2 3.02Å; R303-D339 VanDerWaalsContact NH1-OD2 3.14Å; R303-D339 IonicContact NH2-OD1 3.91Å; R303-D339 PolarHBondContact NH2-OD1 3.08Å; R303-D339 IonicContact NH2-OD2 2.67Å; R303-D339 PolarHBondContact NH2-OD2 3.38Å
304	E	98.9	Very high	98.8	Very high	95 Å²	95	47.7 Å²	47.7	44%	0.444	24%	0.241	S	C	.	.	H	α-helix	trans	-56.6	-48.2	178.3	-73.4	174.2	-158	0	0	111.6	T300 K301 T307 K308	T300-E304 WeakPolarHBondContact O-CG 3.48Å; T300-E304 PolarHBondContact O-N 3.22Å; K301-E304 VanDerWaalsContact CD-OE2 3.28Å; K301-E304 WeakPolarHBondContact CD-OE2 3.4Å; K301-E304 IonicContact NZ-OE1 2.79Å; K301-E304 PolarHBondContact NZ-OE1 2.87Å; K301-E304 IonicContact NZ-OE2 2.65Å; K301-E304 PolarHBondContact NZ-OE2 3.13Å; K301-E304 PolarHBondContact O-N 3.28Å; E304-T307 PolarHBondContact O-N 3Å; E304-K308 WeakPolarHBondContact O-CB 3.38Å; E304-K308 PolarHBondContact O-N 2.92Å
305	L	98.9	Very high	98.8	Very high	12 Å²	12	47 Å²	47	6%	0.063	24%	0.236	C	C	.	.	H	α-helix	trans	-68.3	-45.2	-177.9	-70.2	175.5	0	0	0	112.2	I265 L268 E269 L272 K301 V302 R303 T307 K308 Y309	I265-L305 HydrophobicContact CG2-CD1 3.92Å; L268-L305 HydrophobicContact CD2-CD1 4.24Å; L268-L305 HydrophobicContact CG-CD1 4.36Å; E269-L305 HydrophobicContact CB-CD1 3.91Å; E269-L305 HydrophobicContact CB-CD2 3.96Å; E269-L305 HydrophobicContact CG-CD2 3.82Å; L272-L305 HydrophobicContact CD1-CB 3.68Å; K301-L305 WeakPolarHBondContact O-CB 3.39Å; K301-L305 VanDerWaalsContact O-CG 3.27Å; K301-L305 WeakPolarHBondContact O-CG 3.45Å; K301-L305 PolarHBondContact O-N 3.06Å; V302-L305 PolarHBondContact O-N 3.35Å; R303-L305 PolarHBondContact O-N 2.73Å; L305-T307 VanDerWaalsContact C-N 3.27Å; L305-T307 PolarHBondContact O-N 3.19Å; L305-K308 HydrophobicContact CD2-CD 4.47Å; L305-K308 PolarHBondContact O-N 3.14Å; L305-K308 VanDerWaalsContact O-N 3.14Å; L305-Y309 HydrophobicContact CD2-CE2 3.99Å; L305-Y309 VanDerWaalsContact O-CD2 3.25Å; L305-Y309 WeakPolarHBondContact O-CD2 3.34Å; L305-Y309 PolarHBondContact O-N 3.39Å
306	C	98.9	Very high	98.8	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-57.8	-43.2	177.5	-71	0	0	0	0	110.9	V302 N310 V311 W313	V302-C306 WeakPolarHBondContact O-CB 3.47Å; V302-C306 PolarHBondContact O-N 2.81Å; V302-C306 PolarHBondContact O-SG 3.21Å; C306-N310 PolarHBondContact O-N 3.48Å; C306-N310 VanDerWaalsContact O-N 3.14Å; C306-V311 CarbonylContact C-O 3.04Å; C306-V311 VanDerWaalsContact CB-O 3.29Å; C306-V311 WeakPolarHBondContact CB-O 3.09Å; C306-V311 PolarHBondContact O-N 3.34Å; C306-V311 VanDerWaalsContact O-O 3.08Å; C306-W313 HydrophobicContact CB-CB 4.03Å
307	T	98.8	Very high	98.9	Very high	94 Å²	94	33 Å²	33	58%	0.577	17%	0.168	S	C	*	.	H	α-helix	trans	-63.1	-48.1	173.7	-59.3	0	0	0	0	112.2	R303 E304 L305 Y309 N310	R303-T307 PolarHBondContact NE-OG1 3.35Å; R303-T307 PolarHBondContact NH2-OG1 3.4Å; R303-T307 PolarHBondContact O-N 3.48Å; R303-T307 VanDerWaalsContact O-N 3.1Å; R303-T307 PolarHBondContact O-OG1 3.1Å; R303-T307 VanDerWaalsContact O-OG1 3.06Å; E304-T307 PolarHBondContact O-N 3Å; L305-T307 VanDerWaalsContact C-N 3.27Å; L305-T307 PolarHBondContact O-N 3.19Å; T307-Y309 VanDerWaalsContact C-N 3.28Å; T307-Y309 PolarHBondContact O-N 3.47Å; T307-N310 PolarHBondContact O-N 2.87Å
308	K	98.8	Very high	98.9	Very high	133 Å²	133	32.8 Å²	32.8	58%	0.578	16%	0.162	S	C	*	.	H	α-helix	trans	-56	-40.3	-179.9	175.9	-177.5	171.8	-172.5	0	112.7	E269 E304 L305	E269-K308 IonicContact OE1-NZ 3.02Å; E269-K308 PolarHBondContact OE1-NZ 2.93Å; E304-K308 WeakPolarHBondContact O-CB 3.38Å; E304-K308 PolarHBondContact O-N 2.92Å; L305-K308 HydrophobicContact CD2-CD 4.47Å; L305-K308 PolarHBondContact O-N 3.14Å; L305-K308 VanDerWaalsContact O-N 3.14Å
309	Y	98.8	Very high	98.9	Very high	39 Å²	39	33.1 Å²	33.1	15%	0.153	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	6.8	-176.2	-68.1	-76.5	0	0	0	113.9	K214 E269 L272 Q273 L305 T307 V311	K214-Y309 PolarHBondContact NZ-O 2.72Å; E269-Y309 HydrophobicContact CG-CE2 3.95Å; E269-Y309 PolarHBondContact OE1-OH 3.33Å; L272-Y309 HydrophobicContact CB-CD2 3.74Å; L272-Y309 HydrophobicContact CB-CE2 4.36Å; L272-Y309 HydrophobicContact CB-CG 3.9Å; L272-Y309 HydrophobicContact CD1-CD2 4.28Å; L272-Y309 WeakPolarHBondContact O-CD1 3.28Å; Q273-Y309 HydrophobicContact CG-CE1 3.8Å; L305-Y309 HydrophobicContact CD2-CE2 3.99Å; L305-Y309 VanDerWaalsContact O-CD2 3.25Å; L305-Y309 WeakPolarHBondContact O-CD2 3.34Å; L305-Y309 PolarHBondContact O-N 3.39Å; T307-Y309 VanDerWaalsContact C-N 3.28Å; T307-Y309 PolarHBondContact O-N 3.47Å; Y309-V311 VanDerWaalsContact C-N 3.3Å; Y309-V311 PolarHBondContact O-N 3.15Å
310	N	98.7	Very high	98.9	Very high	92 Å²	92	32.8 Å²	32.8	49%	0.492	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	51.6	-174.2	-170.6	29	0	0	0	111.5	W209 K214 C306 T307	W209-N310 WeakPolarHBondContact CH2-O 3.16Å; K214-N310 WeakPolarHBondContact CD-O 3.32Å; K214-N310 VanDerWaalsContact CE-O 3.27Å; K214-N310 WeakPolarHBondContact CE-O 3.33Å; K214-N310 PolarHBondContact NZ-O 2.99Å; C306-N310 PolarHBondContact O-N 3.48Å; C306-N310 VanDerWaalsContact O-N 3.14Å; T307-N310 PolarHBondContact O-N 2.87Å
311	V	98.9	Very high	98.9	Very high	4 Å²	4	30.9 Å²	30.9	2%	0.024	15%	0.15	C	C	.	.			trans	-116.5	137.7	178	172.2	0	0	0	0	107.5	L272 V277 A279 C306 Y309	L272-V311 HydrophobicContact CD2-CB 3.94Å; L272-V311 HydrophobicContact CD2-CG1 3.66Å; L272-V311 HydrophobicContact CD2-CG2 3.84Å; V277-V311 HydrophobicContact CB-CG2 4.11Å; V277-V311 HydrophobicContact CG1-CG1 3.76Å; V277-V311 HydrophobicContact CG1-CG2 3.95Å; A279-V311 VanDerWaalsContact CA-CG1 3.47Å; C306-V311 CarbonylContact C-O 3.04Å; C306-V311 VanDerWaalsContact CB-O 3.29Å; C306-V311 WeakPolarHBondContact CB-O 3.09Å; C306-V311 PolarHBondContact O-N 3.34Å; C306-V311 VanDerWaalsContact O-O 3.08Å; Y309-V311 VanDerWaalsContact C-N 3.3Å; Y309-V311 PolarHBondContact O-N 3.15Å
312	L	98.9	Very high	98.9	Very high	8 Å²	8	26.8 Å²	26.8	4%	0.042	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	133.4	176.9	-63.2	172	0	0	0	110.8	A206 W209 A278 A279 F280 D339 L340 V363	A206-L312 HydrophobicContact CB-CD1 4.19Å; W209-L312 HydrophobicContact CB-CD1 4.07Å; W209-L312 HydrophobicContact CD2-CD1 3.55Å; W209-L312 HydrophobicContact CD2-CD2 4.18Å; W209-L312 HydrophobicContact CD2-CG 3.92Å; W209-L312 HydrophobicContact CE3-CD1 3.44Å; W209-L312 VanDerWaalsContact CE3-CD1 3.44Å; W209-L312 HydrophobicContact CE3-CD2 4.37Å; W209-L312 HydrophobicContact CE3-CG 3.66Å; W209-L312 HydrophobicContact CG-CD1 3.83Å; W209-L312 HydrophobicContact CH2-CD2 4.3Å; W209-L312 HydrophobicContact CH2-CG 4.08Å; W209-L312 HydrophobicContact CZ2-CD2 4.1Å; W209-L312 HydrophobicContact CZ2-CG 4.31Å; W209-L312 HydrophobicContact CZ3-CD1 4.07Å; W209-L312 HydrophobicContact CZ3-CD2 4.42Å; W209-L312 HydrophobicContact CZ3-CG 3.75Å; A278-L312 PolarHBondContact O-N 3.33Å; A279-L312 CarbonylContact C-O 3.46Å; A279-L312 WeakPolarHBondContact CA-O 3.21Å; A279-L312 HydrophobicContact CB-CB 4.04Å; A279-L312 VanDerWaalsContact CB-O 3.31Å; A279-L312 WeakPolarHBondContact CB-O 3.27Å; F280-L312 PolarHBondContact N-O 2.99Å; L312-D339 WeakPolarHBondContact CA-OD2 3.26Å; L312-D339 HydrophobicContact CB-CB 4.36Å; L312-D339 HydrophobicContact CD2-CB 3.78Å; L312-L340 HydrophobicContact CB-CD1 4.05Å; L312-L340 HydrophobicContact CD1-CD1 4.03Å; L312-L340 HydrophobicContact CG-CD1 4.45Å; L312-V363 HydrophobicContact CD1-CG1 4.19Å; L312-V363 HydrophobicContact CD1-CG2 4.14Å; L312-V363 HydrophobicContact CD2-CG2 3.7Å
313	W	98.9	Very high	98.9	Very high	1 Å²	1	26.8 Å²	26.8	0%	0.004	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	120.3	166.3	178	25.1	0	0	0	110.4	L299 V302 R303 C306 A315 V331 V336 P338 D339 L340	L299-W313 HydrophobicContact CB-CH2 4.27Å; L299-W313 HydrophobicContact CB-CZ2 4.47Å; L299-W313 HydrophobicContact CD2-CZ2 4.15Å; V302-W313 HydrophobicContact CG1-CD2 3.88Å; V302-W313 HydrophobicContact CG1-CG 3.91Å; R303-W313 HydrophobicContact CB-CE3 3.98Å; R303-W313 HydrophobicContact CB-CZ3 3.88Å; R303-W313 HydrophobicContact CG-CE3 4.48Å; R303-W313 HydrophobicContact CG-CZ3 4.43Å; C306-W313 HydrophobicContact CB-CB 4.03Å; W313-A315 HydrophobicContact CZ2-CB 4.22Å; W313-V331 HydrophobicContact CH2-CB 4.19Å; W313-V331 HydrophobicContact CH2-CG1 3.6Å; W313-V331 HydrophobicContact CZ2-CG1 3.7Å; W313-V336 HydrophobicContact CH2-CB 4.27Å; W313-V336 HydrophobicContact CH2-CG2 3.54Å; W313-V336 HydrophobicContact CZ3-CB 3.94Å; W313-V336 HydrophobicContact CZ3-CG2 3.74Å; W313-P338 HydrophobicContact CD2-CB 3.7Å; W313-P338 VanDerWaalsContact CE3-CA 3.49Å; W313-P338 HydrophobicContact CE3-CB 3.72Å; W313-P338 HydrophobicContact CG-CB 4.16Å; W313-P338 HydrophobicContact CH2-CB 4.34Å; W313-P338 HydrophobicContact CZ2-CB 4.35Å; W313-P338 HydrophobicContact CZ3-CB 4.04Å; W313-D339 PolarHBondContact N-OD2 2.95Å; W313-D339 PolarHBondContact O-N 3.21Å; W313-L340 PolarHBondContact O-N 3.07Å
314	I	99	Very high	98.9	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	112.8	171.6	-55	165.6	0	0	0	108.1	A202 A206 A279 F280 M281 V282 L340 I342	A202-I314 HydrophobicContact CB-CD1 4.14Å; A202-I314 HydrophobicContact CB-CG2 3.86Å; A206-I314 HydrophobicContact CB-CD1 4.08Å; A279-I314 HydrophobicContact CB-CD1 3.65Å; A279-I314 HydrophobicContact CB-CG1 4.13Å; F280-I314 PolarHBondContact O-N 3.01Å; M281-I314 WeakPolarHBondContact CA-O 3.33Å; M281-I314 HydrophobicContact CB-CB 4.01Å; M281-I314 HydrophobicContact CB-CD1 4.25Å; M281-I314 HydrophobicContact CB-CG2 4.38Å; M281-I314 HydrophobicContact CG-CB 4.06Å; M281-I314 HydrophobicContact CG-CG2 3.89Å; M281-I314 HydrophobicContact SD-CG2 4.13Å; V282-I314 PolarHBondContact N-O 3.25Å; I314-L340 WeakPolarHBondContact CA-O 3.45Å; I314-L340 HydrophobicContact CB-CB 4.5Å; I314-L340 HydrophobicContact CG1-CB 4.16Å; I314-L340 HydrophobicContact CG1-CD1 3.79Å; I314-L340 HydrophobicContact CG1-CG 4.44Å; I314-L340 HydrophobicContact CG2-CB 4.32Å; I314-I342 HydrophobicContact CG2-CD1 3.66Å; I314-I342 HydrophobicContact CG2-CG1 4.05Å
315	A	98.9	Very high	98.9	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	117	170.9	0	0	0	0	0	110.1	W313 E317 V331 P338 L340 V341 I342	W313-A315 HydrophobicContact CZ2-CB 4.22Å; A315-E317 HydrophobicContact CB-CG 4.23Å; A315-E317 PolarHBondContact O-N 3.09Å; A315-V331 HydrophobicContact CB-CG1 4.04Å; A315-P338 HydrophobicContact CB-CB 3.69Å; A315-P338 HydrophobicContact CB-CG 3.61Å; A315-L340 PolarHBondContact N-O 2.87Å; A315-V341 WeakPolarHBondContact O-CA 3.45Å; A315-I342 PolarHBondContact O-N 2.82Å
316	D	98.9	Very high	98.9	Very high	10 Å²	10	20 Å²	20	5%	0.053	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	97.2	169	-168.7	-21.4	0	0	0	109.4	W231 M281 V282 E283 P284 V318 I342	W231-D316 WeakPolarHBondContact CB-OD2 3.25Å; M281-D316 HydrophobicContact CE-CB 4.1Å; V282-D316 PolarHBondContact O-N 3.07Å; E283-D316 HydrophobicContact CG-CB 4.03Å; P284-D316 WeakPolarHBondContact CD-O 3.35Å; D316-V318 WeakPolarHBondContact OD1-CB 3.22Å; D316-V318 WeakPolarHBondContact OD1-CG2 3.3Å; D316-V318 PolarHBondContact OD1-N 3.04Å; D316-I342 HydrophobicContact CB-CD1 4.49Å
317	E	98.9	Very high	98.9	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.121	C	C	.	.			trans	-102.8	17.2	179.2	-71.8	-96.2	-157.4	0	0	111.4	P284 A315 Q319 T320 G321 L329 A330 V331 V341 I342 L343	P284-E317 HydrophobicContact CG-CG 4.04Å; A315-E317 HydrophobicContact CB-CG 4.23Å; A315-E317 PolarHBondContact O-N 3.09Å; E317-Q319 PolarHBondContact O-N 2.88Å; E317-T320 WeakPolarHBondContact CA-OG1 3.46Å; E317-T320 VanDerWaalsContact OE2-C 3.25Å; E317-T320 WeakPolarHBondContact OE2-CB 3.32Å; E317-T320 PolarHBondContact OE2-OG1 3.49Å; E317-G321 WeakPolarHBondContact O-CA 3.45Å; E317-G321 PolarHBondContact O-N 3.18Å; E317-G321 WeakPolarHBondContact OE2-CA 3.18Å; E317-G321 PolarHBondContact OE2-N 3.14Å; E317-L329 HydrophobicContact CB-CD2 4.35Å; E317-L329 HydrophobicContact CG-CD2 4.4Å; E317-L329 WeakPolarHBondContact OE1-CB 3.14Å; E317-A330 VanDerWaalsContact CD-N 3.27Å; E317-A330 WeakPolarHBondContact OE1-CA 3.29Å; E317-A330 PolarHBondContact OE1-N 2.93Å; E317-A330 VanDerWaalsContact OE2-CB 3.31Å; E317-A330 WeakPolarHBondContact OE2-CB 3.43Å; E317-A330 PolarHBondContact OE2-N 3.46Å; E317-V331 WeakPolarHBondContact OE1-CG1 3.45Å; E317-V331 PolarHBondContact OE1-N 3.11Å; E317-V341 HydrophobicContact CB-CG2 3.77Å; E317-V341 HydrophobicContact CG-CG2 3.75Å; E317-I342 CarbonylContact C-O 3.51Å; E317-I342 VanDerWaalsContact C-O 3.25Å; E317-I342 WeakPolarHBondContact CA-O 3.23Å; E317-I342 WeakPolarHBondContact CB-O 3.37Å; E317-I342 PolarHBondContact N-O 2.76Å; E317-L343 HydrophobicContact CB-CD2 3.83Å
318	V	98.9	Very high	98.8	Very high	18 Å²	18	25.6 Å²	25.6	11%	0.109	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-38.3	-179.3	170.7	0	0	0	0	111	D316 I342 K345	D316-V318 WeakPolarHBondContact OD1-CB 3.22Å; D316-V318 WeakPolarHBondContact OD1-CG2 3.3Å; D316-V318 PolarHBondContact OD1-N 3.04Å; V318-I342 HydrophobicContact CG2-CB 4.24Å; V318-I342 HydrophobicContact CG2-CG2 3.59Å; V318-I342 PolarHBondContact N-O 3.05Å; V318-K345 HydrophobicContact CG1-CB 4.42Å; V318-K345 HydrophobicContact CG1-CD 3.89Å; V318-K345 HydrophobicContact CG1-CG 3.71Å; V318-K345 WeakPolarHBondContact O-CB 3.35Å; V318-K345 WeakPolarHBondContact O-CD 3.45Å
319	Q	98.8	Very high	98.9	Very high	12 Å²	12	19.6 Å²	19.6	6%	0.056	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-33.6	178.4	-167.4	162	43.1	0	0	114.4	Y138 G287 E288 E317 R324 K345	Y138-Q319 PolarHBondContact O-NE2 2.59Å; Y138-Q319 VanDerWaalsContact O-NE2 3.07Å; G287-Q319 VanDerWaalsContact CA-OE1 3.23Å; E288-Q319 PolarHBondContact OE1-NE2 2.7Å; E317-Q319 PolarHBondContact O-N 2.88Å; Q319-R324 WeakPolarHBondContact O-CG 3.39Å; Q319-K345 HydrophobicContact CB-CD 4.39Å
320	T	98.9	Very high	98.9	Very high	1 Å²	1	18 Å²	18	1%	0.006	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-22	-171.5	55.2	0	0	0	0	113.6	I285 E317 T325 L430	I285-T320 HydrophobicContact CB-CG2 3.82Å; I285-T320 HydrophobicContact CG1-CG2 4.49Å; I285-T320 WeakPolarHBondContact O-CG2 3.44Å; E317-T320 WeakPolarHBondContact CA-OG1 3.46Å; E317-T320 VanDerWaalsContact OE2-C 3.25Å; E317-T320 WeakPolarHBondContact OE2-CB 3.32Å; E317-T320 PolarHBondContact OE2-OG1 3.49Å; T320-T325 VanDerWaalsContact O-CG2 3.3Å; T320-T325 WeakPolarHBondContact O-CG2 3.31Å; T320-T325 PolarHBondContact O-OG1 3.16Å; T320-L430 HydrophobicContact CG2-CD2 4.14Å
321	G	98.7	Very high	98.9	Very high	3 Å²	3	13.7 Å²	13.7	3%	0.031	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-172.3	-176.7	0	0	0	0	0	113.1	E317 R324 R328	E317-G321 WeakPolarHBondContact O-CA 3.45Å; E317-G321 PolarHBondContact O-N 3.18Å; E317-G321 WeakPolarHBondContact OE2-CA 3.18Å; E317-G321 PolarHBondContact OE2-N 3.14Å; G321-R324 VanDerWaalsContact O-CB 3.32Å; G321-R324 WeakPolarHBondContact O-CB 3.21Å; G321-R324 PolarHBondContact O-N 3.38Å; G321-R328 CarbonylContact C-O 3.44Å
322	L	98.9	Very high	98.9	Very high	4 Å²	4	16.7 Å²	16.7	2%	0.021	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	58.5	173.3	-52.4	178.5	0	0	0	112.4	N142 F184 R324 R328 L343 A346 L347 L390 M393	N142-L322 PolarHBondContact ND2-O 3.47Å; F184-L322 HydrophobicContact CE1-CD2 4.39Å; F184-L322 HydrophobicContact CE2-CD2 4.49Å; F184-L322 HydrophobicContact CZ-CD2 3.65Å; L322-R324 PolarHBondContact O-N 3.49Å; L322-R324 VanDerWaalsContact O-N 3.08Å; L322-R328 WeakPolarHBondContact CA-O 3.48Å; L322-R328 PolarHBondContact N-O 2.86Å; L322-L343 HydrophobicContact CD2-CD1 4.36Å; L322-L343 HydrophobicContact CD2-CD2 4.46Å; L322-A346 HydrophobicContact CB-CB 4.08Å; L322-A346 VanDerWaalsContact CD1-C 3.41Å; L322-A346 HydrophobicContact CD1-CB 3.9Å; L322-L347 HydrophobicContact CD1-CB 3.79Å; L322-L347 HydrophobicContact CD1-CD1 4.46Å; L322-L390 HydrophobicContact CD2-CD2 3.72Å; L322-M393 VanDerWaalsContact CA-SD 3.56Å; L322-M393 HydrophobicContact CB-SD 4.02Å; L322-M393 HydrophobicContact CD2-SD 4.33Å
323	A	98.9	Very high	98.8	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.9	-14.5	178.3	0	0	0	0	0	116.5	T325 G326 R327 R328 M393 L398 A399 A402 L471	A323-T325 VanDerWaalsContact C-N 3.26Å; A323-T325 PolarHBondContact O-N 3.14Å; A323-T325 VanDerWaalsContact O-N 3.1Å; A323-G326 PolarHBondContact O-N 3.4Å; A323-R327 WeakPolarHBondContact CA-O 3.5Å; A323-R327 PolarHBondContact N-O 3.43Å; A323-R328 PolarHBondContact N-O 2.82Å; A323-M393 HydrophobicContact CB-CG 3.72Å; A323-M393 HydrophobicContact CB-SD 3.95Å; A323-L398 HydrophobicContact CB-CB 3.87Å; A323-A399 HydrophobicContact CB-CB 3.88Å; A323-A402 VanDerWaalsContact O-CB 3.24Å; A323-A402 WeakPolarHBondContact O-CB 3.45Å; A323-L471 HydrophobicContact CB-CD1 3.6Å
324	R	98.9	Very high	98.8	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-42.3	-171.7	174.3	51.5	56.9	-176.7	0.4	113.5	S139 N142 Q319 G321 L322 L429 L430 P469 L471	S139-R324 PolarHBondContact OG-NE 3.45Å; N142-R324 VanDerWaalsContact OD1-CZ 3.27Å; N142-R324 PolarHBondContact OD1-NE 3.36Å; N142-R324 VanDerWaalsContact OD1-NE 3.08Å; N142-R324 PolarHBondContact OD1-NH2 2.96Å; Q319-R324 WeakPolarHBondContact O-CG 3.39Å; G321-R324 VanDerWaalsContact O-CB 3.32Å; G321-R324 WeakPolarHBondContact O-CB 3.21Å; G321-R324 PolarHBondContact O-N 3.38Å; L322-R324 PolarHBondContact O-N 3.49Å; L322-R324 VanDerWaalsContact O-N 3.08Å; R324-L429 PolarHBondContact NH1-O 2.94Å; R324-L429 PolarHBondContact O-N 3.41Å; R324-L430 HydrophobicContact CG-CB 3.85Å; R324-P469 PolarHBondContact NH1-O 3.26Å; R324-P469 PolarHBondContact NH2-O 3.29Å; R324-P469 VanDerWaalsContact NH2-O 3.09Å; R324-L471 VanDerWaalsContact CZ-CD2 3.43Å
325	T	98.9	Very high	98.8	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	6.5	-176.4	58.7	0	0	0	0	114.3	I285 T320 A323 A330 H333 K427 G428 L430	I285-T325 HydrophobicContact CD1-CG2 3.83Å; T320-T325 VanDerWaalsContact O-CG2 3.3Å; T320-T325 WeakPolarHBondContact O-CG2 3.31Å; T320-T325 PolarHBondContact O-OG1 3.16Å; A323-T325 VanDerWaalsContact C-N 3.26Å; A323-T325 PolarHBondContact O-N 3.14Å; A323-T325 VanDerWaalsContact O-N 3.1Å; T325-A330 HydrophobicContact CG2-CB 3.98Å; T325-A330 WeakPolarHBondContact OG1-CA 3.37Å; T325-A330 WeakPolarHBondContact OG1-CB 3.13Å; T325-H333 PolarHBondContact O-CE1 3.23Å; T325-H333 PolarHBondContact O-NE2 3.4Å; T325-K427 HydrophobicContact CG2-CB 4.38Å; T325-G428 WeakPolarHBondContact O-CA 3.32Å; T325-G428 PolarHBondContact O-N 3.18Å; T325-L430 HydrophobicContact CG2-CD2 4.47Å
326	G	98.8	Very high	98.8	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.01	13%	0.132	C	C	.	.	S	Bend	trans	94.5	7.6	-178.8	0	0	0	0	0	115.1	A323 A399	A323-G326 PolarHBondContact O-N 3.4Å; G326-A399 CarbonylContact C-O 3.54Å; G326-A399 VanDerWaalsContact CA-O 3.23Å; G326-A399 WeakPolarHBondContact CA-O 3.41Å
327	R	98.8	Very high	98.7	Very high	104 Å²	104	28.6 Å²	28.6	39%	0.392	15%	0.147	S	C	.	.	S	Bend	trans	-141.2	163.9	174.8	-65.5	-64.9	-179.9	-100.1	3.2	108.7	A323 L329 D332 H333	A323-R327 WeakPolarHBondContact CA-O 3.5Å; A323-R327 PolarHBondContact N-O 3.43Å; R327-L329 VanDerWaalsContact C-N 3.34Å; R327-L329 WeakPolarHBondContact CB-O 3.34Å; R327-L329 PolarHBondContact O-N 3.42Å; R327-D332 HydrophobicContact CB-CB 3.96Å; R327-D332 HydrophobicContact CG-CB 4.27Å; R327-H333 WeakPolarHBondContact CG-NE2 3.45Å
328	R	98.5	Very high	98.7	Very high	108 Å²	108	28.7 Å²	28.7	41%	0.408	15%	0.147	S	C	.	.	S	Bend	trans	-56.3	-52.1	177.2	-75.6	-178.2	-177	148.5	2.6	110.3	G321 L322 A323 M393 E394	G321-R328 CarbonylContact C-O 3.44Å; L322-R328 WeakPolarHBondContact CA-O 3.48Å; L322-R328 PolarHBondContact N-O 2.86Å; A323-R328 PolarHBondContact N-O 2.82Å; R328-M393 HydrophobicContact CG-CE 4.4Å; R328-E394 IonicContact CZ-OE1 2.68Å; R328-E394 IonicContact CZ-OE2 3.48Å; R328-E394 IonicContact NE-OE1 3.73Å; R328-E394 PolarHBondContact NE-OE1 2.76Å; R328-E394 IonicContact NE-OE2 2.67Å; R328-E394 PolarHBondContact NE-OE2 3.49Å; R328-E394 IonicContact NH2-OE1 3.55Å; R328-E394 IonicContact NH2-OE2 3.87Å; R328-E394 PolarHBondContact NH2-OE2 3.15Å
329	L	98.9	Very high	98.7	Very high	7 Å²	7	29.6 Å²	29.6	4%	0.037	15%	0.151	C	C	.	.	S	Bend	trans	-117.5	149.4	169.7	-59.2	180	0	0	0	109.6	F184 E317 R327 V331 D332 V341 L343	F184-L329 HydrophobicContact CD1-CD1 3.82Å; F184-L329 HydrophobicContact CD1-CD2 4.03Å; F184-L329 HydrophobicContact CD1-CG 3.9Å; F184-L329 HydrophobicContact CE1-CD1 4.32Å; F184-L329 HydrophobicContact CE1-CD2 3.69Å; F184-L329 HydrophobicContact CE1-CG 3.91Å; E317-L329 HydrophobicContact CB-CD2 4.35Å; E317-L329 HydrophobicContact CG-CD2 4.4Å; E317-L329 WeakPolarHBondContact OE1-CB 3.14Å; R327-L329 VanDerWaalsContact C-N 3.34Å; R327-L329 WeakPolarHBondContact CB-O 3.34Å; R327-L329 PolarHBondContact O-N 3.42Å; L329-V331 VanDerWaalsContact C-N 3.26Å; L329-V331 HydrophobicContact CB-CG2 3.76Å; L329-V331 HydrophobicContact CD1-CG2 4.26Å; L329-V331 PolarHBondContact O-N 3.27Å; L329-D332 PolarHBondContact N-OD2 2.9Å; L329-D332 VanDerWaalsContact O-CB 3.27Å; L329-D332 WeakPolarHBondContact O-CB 3.25Å; L329-D332 PolarHBondContact O-N 3.36Å; L329-D332 VanDerWaalsContact O-N 3.17Å; L329-V341 HydrophobicContact CD1-CG2 4.31Å; L329-V341 HydrophobicContact CD2-CG2 4.5Å; L329-L343 HydrophobicContact CD2-CD2 3.68Å
330	A	98.9	Very high	98.8	Very high	5 Å²	5	29 Å²	29	4%	0.041	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-65.9	-30.9	177.5	0	0	0	0	0	112.6	P284 E317 T325 D332 H333	P284-A330 HydrophobicContact CB-CB 3.63Å; P284-A330 HydrophobicContact CG-CB 4.12Å; E317-A330 VanDerWaalsContact CD-N 3.27Å; E317-A330 WeakPolarHBondContact OE1-CA 3.29Å; E317-A330 PolarHBondContact OE1-N 2.93Å; E317-A330 VanDerWaalsContact OE2-CB 3.31Å; E317-A330 WeakPolarHBondContact OE2-CB 3.43Å; E317-A330 PolarHBondContact OE2-N 3.46Å; T325-A330 HydrophobicContact CG2-CB 3.98Å; T325-A330 WeakPolarHBondContact OG1-CA 3.37Å; T325-A330 WeakPolarHBondContact OG1-CB 3.13Å; A330-D332 PolarHBondContact O-N 3.23Å; A330-H333 WeakPolarHBondContact O-CB 3.3Å; A330-H333 PolarHBondContact O-CD2 3.15Å; A330-H333 PolarHBondContact O-N 3.15Å; A330-H333 VanDerWaalsContact O-N 3.16Å
331	V	98.8	Very high	98.8	Very high	1 Å²	1	29 Å²	29	1%	0.006	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-59.3	-25.7	172.9	-64.7	0	0	0	0	113.2	P284 L299 W313 A315 E317 L329 H333 E334 G335 V336	P284-V331 HydrophobicContact CG-CG1 3.87Å; L299-V331 HydrophobicContact CD1-CG1 4.38Å; W313-V331 HydrophobicContact CH2-CB 4.19Å; W313-V331 HydrophobicContact CH2-CG1 3.6Å; W313-V331 HydrophobicContact CZ2-CG1 3.7Å; A315-V331 HydrophobicContact CB-CG1 4.04Å; E317-V331 WeakPolarHBondContact OE1-CG1 3.45Å; E317-V331 PolarHBondContact OE1-N 3.11Å; L329-V331 VanDerWaalsContact C-N 3.26Å; L329-V331 HydrophobicContact CB-CG2 3.76Å; L329-V331 HydrophobicContact CD1-CG2 4.26Å; L329-V331 PolarHBondContact O-N 3.27Å; V331-H333 PolarHBondContact O-N 3.28Å; V331-E334 PolarHBondContact O-N 3.26Å; V331-G335 PolarHBondContact O-N 3.4Å; V331-V336 HydrophobicContact CB-CG2 4.28Å
332	D	98.8	Very high	98.8	Very high	68 Å²	68	28.8 Å²	28.8	36%	0.364	15%	0.147	S	C	.	.	G	3₁₀ helix	trans	-65.6	-19.7	178.6	-58.9	-24.6	0	0	0	112.5	R327 L329 A330 E334 G335	R327-D332 HydrophobicContact CB-CB 3.96Å; R327-D332 HydrophobicContact CG-CB 4.27Å; L329-D332 PolarHBondContact N-OD2 2.9Å; L329-D332 VanDerWaalsContact O-CB 3.27Å; L329-D332 WeakPolarHBondContact O-CB 3.25Å; L329-D332 PolarHBondContact O-N 3.36Å; L329-D332 VanDerWaalsContact O-N 3.17Å; A330-D332 PolarHBondContact O-N 3.23Å; D332-E334 PolarHBondContact O-N 3.15Å; D332-G335 PolarHBondContact O-N 2.63Å
333	H	98.7	Very high	98.8	Very high	52 Å²	52	28.6 Å²	28.6	24%	0.241	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-61.5	-25.9	173.3	-80.8	-80.2	0	0	0	112.8	T325 R327 A330 V331	T325-H333 PolarHBondContact O-CE1 3.23Å; T325-H333 PolarHBondContact O-NE2 3.4Å; R327-H333 WeakPolarHBondContact CG-NE2 3.45Å; A330-H333 WeakPolarHBondContact O-CB 3.3Å; A330-H333 PolarHBondContact O-CD2 3.15Å; A330-H333 PolarHBondContact O-N 3.15Å; A330-H333 VanDerWaalsContact O-N 3.16Å; V331-H333 PolarHBondContact O-N 3.28Å
334	E	98.4	Very high	98.8	Very high	33 Å²	33	28.6 Å²	28.6	15%	0.154	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-111.4	6.4	177.1	-66	-163.4	-167	0	0	112.7	G297 L299 T300 V331 D332 V336	G297-E334 VanDerWaalsContact C-OE2 3.26Å; G297-E334 WeakPolarHBondContact CA-OE2 3.32Å; G297-E334 PolarHBondContact N-OE1 2.75Å; L299-E334 PolarHBondContact N-OE2 3.38Å; T300-E334 WeakPolarHBondContact CB-OE2 3.13Å; T300-E334 PolarHBondContact N-OE2 2.98Å; T300-E334 PolarHBondContact OG1-OE2 2.61Å; V331-E334 PolarHBondContact O-N 3.26Å; D332-E334 PolarHBondContact O-N 3.15Å; E334-V336 HydrophobicContact CB-CG2 4.14Å; E334-V336 PolarHBondContact O-N 2.98Å
335	G	98.3	Very high	98.8	Very high	72 Å²	72	31.2 Å²	31.2	74%	0.742	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.5	28	177	0	0	0	0	0	113.8	V331 D332	V331-G335 PolarHBondContact O-N 3.4Å; D332-G335 PolarHBondContact O-N 2.63Å
336	V	98.5	Very high	98.7	Very high	17 Å²	17	31.4 Å²	31.4	10%	0.103	16%	0.158	C	C	.	.			trans	-110.3	144.6	-178.7	-71.1	0	0	0	0	112.1	L299 R303 W313 V331 E334	L299-V336 HydrophobicContact CB-CG2 4.09Å; R303-V336 HydrophobicContact CB-CB 4.18Å; R303-V336 HydrophobicContact CB-CG1 3.98Å; R303-V336 HydrophobicContact CG-CB 4.29Å; R303-V336 HydrophobicContact CG-CG1 4.15Å; W313-V336 HydrophobicContact CH2-CB 4.27Å; W313-V336 HydrophobicContact CH2-CG2 3.54Å; W313-V336 HydrophobicContact CZ3-CB 3.94Å; W313-V336 HydrophobicContact CZ3-CG2 3.74Å; V331-V336 HydrophobicContact CB-CG2 4.28Å; E334-V336 HydrophobicContact CB-CG2 4.14Å; E334-V336 PolarHBondContact O-N 2.98Å
337	R	98.6	Very high	98.8	Very high	95 Å²	95	31.3 Å²	31.3	36%	0.358	16%	0.158	S	C	.	.			trans	-111.1	121.1	179.3	-174.8	177.2	174.1	-90.6	11	110.8	G185 R303 D360	G185-R337 PolarHBondContact O-NE 3.12Å; G185-R337 VanDerWaalsContact O-NE 3.16Å; G185-R337 PolarHBondContact O-NH2 2.92Å; R303-R337 VanDerWaalsContact CD-O 3.26Å; R303-R337 WeakPolarHBondContact CD-O 3.4Å; R303-R337 PolarHBondContact NH1-O 2.67Å; R337-D360 IonicContact CZ-OD1 2.73Å; R337-D360 IonicContact CZ-OD2 2.74Å; R337-D360 VanDerWaalsContact CZ-OD2 3.29Å; R337-D360 IonicContact NH1-OD2 2.69Å; R337-D360 PolarHBondContact NH1-OD2 2.68Å; R337-D360 IonicContact NH2-OD1 2.83Å; R337-D360 PolarHBondContact NH2-OD1 2.9Å; R337-D360 IonicContact NH2-OD2 2.74Å; R337-D360 PolarHBondContact NH2-OD2 3.09Å
338	P	98.9	Very high	98.7	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.006	14%	0.14	C	C	.	.			trans	-75.7	158.3	174.6	31.7	-34.1	0	0	0	111.2	Y186 W313 A315 L340 V341	Y186-P338 WeakPolarHBondContact CE1-O 3.4Å; Y186-P338 WeakPolarHBondContact OH-CD 3.41Å; Y186-P338 WeakPolarHBondContact OH-CG 3.38Å; Y186-P338 PolarHBondContact OH-O 3.48Å; W313-P338 HydrophobicContact CD2-CB 3.7Å; W313-P338 VanDerWaalsContact CE3-CA 3.49Å; W313-P338 HydrophobicContact CE3-CB 3.72Å; W313-P338 HydrophobicContact CG-CB 4.16Å; W313-P338 HydrophobicContact CH2-CB 4.34Å; W313-P338 HydrophobicContact CZ2-CB 4.35Å; W313-P338 HydrophobicContact CZ3-CB 4.04Å; A315-P338 HydrophobicContact CB-CB 3.69Å; A315-P338 HydrophobicContact CB-CG 3.61Å; P338-L340 VanDerWaalsContact C-N 3.34Å; P338-L340 WeakPolarHBondContact CB-O 3.4Å; P338-V341 HydrophobicContact CG-CB 4.17Å
339	D	98.9	Very high	98.7	Very high	37 Å²	37	21.6 Å²	21.6	20%	0.198	12%	0.123	C	C	.	.	S	Bend	trans	-72.9	-33.3	178.2	-55.5	-47.5	0	0	0	111	R303 L312 W313 S359	R303-D339 IonicContact CZ-OD1 3.55Å; R303-D339 IonicContact CZ-OD2 3.81Å; R303-D339 IonicContact NH1-OD1 3.06Å; R303-D339 PolarHBondContact NH1-OD1 3.06Å; R303-D339 IonicContact NH1-OD2 3.29Å; R303-D339 PolarHBondContact NH1-OD2 3.02Å; R303-D339 VanDerWaalsContact NH1-OD2 3.14Å; R303-D339 IonicContact NH2-OD1 3.91Å; R303-D339 PolarHBondContact NH2-OD1 3.08Å; R303-D339 IonicContact NH2-OD2 2.67Å; R303-D339 PolarHBondContact NH2-OD2 3.38Å; L312-D339 WeakPolarHBondContact CA-OD2 3.26Å; L312-D339 HydrophobicContact CB-CB 4.36Å; L312-D339 HydrophobicContact CD2-CB 3.78Å; W313-D339 PolarHBondContact N-OD2 2.95Å; W313-D339 PolarHBondContact O-N 3.21Å; D339-S359 WeakPolarHBondContact O-CB 3.45Å
340	L	98.9	Very high	98.7	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	140.1	168.1	-55.7	92.1	0	0	0	110.3	A202 L205 L312 W313 I314 A315 P338 V357 L358 V363	A202-L340 HydrophobicContact CB-CD2 4.44Å; L205-L340 HydrophobicContact CB-CD2 3.95Å; L205-L340 HydrophobicContact CD1-CD2 3.84Å; L312-L340 HydrophobicContact CB-CD1 4.05Å; L312-L340 HydrophobicContact CD1-CD1 4.03Å; L312-L340 HydrophobicContact CG-CD1 4.45Å; W313-L340 PolarHBondContact O-N 3.07Å; I314-L340 WeakPolarHBondContact CA-O 3.45Å; I314-L340 HydrophobicContact CB-CB 4.5Å; I314-L340 HydrophobicContact CG1-CB 4.16Å; I314-L340 HydrophobicContact CG1-CD1 3.79Å; I314-L340 HydrophobicContact CG1-CG 4.44Å; I314-L340 HydrophobicContact CG2-CB 4.32Å; A315-L340 PolarHBondContact N-O 2.87Å; P338-L340 VanDerWaalsContact C-N 3.34Å; P338-L340 WeakPolarHBondContact CB-O 3.4Å; L340-V357 HydrophobicContact CD2-CG1 4.04Å; L340-L358 VanDerWaalsContact CA-O 3.26Å; L340-L358 WeakPolarHBondContact CA-O 3.48Å; L340-V363 HydrophobicContact CD1-CG1 4.18Å; L340-V363 HydrophobicContact CD2-CG1 3.99Å; L340-V363 HydrophobicContact CG-CG1 4.27Å
341	V	98.9	Very high	98.6	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	135.7	167.2	62.5	0	0	0	0	110.2	Y186 A315 E317 L329 P338 L343 V357 L358	Y186-V341 HydrophobicContact CD2-CG1 4.21Å; Y186-V341 HydrophobicContact CE2-CG1 3.52Å; A315-V341 WeakPolarHBondContact O-CA 3.45Å; E317-V341 HydrophobicContact CB-CG2 3.77Å; E317-V341 HydrophobicContact CG-CG2 3.75Å; L329-V341 HydrophobicContact CD1-CG2 4.31Å; L329-V341 HydrophobicContact CD2-CG2 4.5Å; P338-V341 HydrophobicContact CG-CB 4.17Å; V341-L343 HydrophobicContact CG2-CD2 3.95Å; V341-L343 HydrophobicContact CG2-CG 4.33Å; V341-V357 WeakPolarHBondContact O-CA 3.46Å; V341-L358 HydrophobicContact CG1-CB 3.78Å; V341-L358 HydrophobicContact CG1-CD1 3.93Å; V341-L358 HydrophobicContact CG1-CG 4.4Å; V341-L358 PolarHBondContact N-O 2.99Å; V341-L358 PolarHBondContact O-N 3.35Å
342	I	98.9	Very high	98.6	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	126	174.3	-50.5	161.6	0	0	0	108.2	A202 M281 I314 A315 D316 E317 V318 A356 V357	A202-I342 HydrophobicContact CB-CD1 3.81Å; A202-I342 HydrophobicContact CB-CG1 3.99Å; M281-I342 HydrophobicContact CE-CD1 3.55Å; M281-I342 HydrophobicContact SD-CD1 4.15Å; I314-I342 HydrophobicContact CG2-CD1 3.66Å; I314-I342 HydrophobicContact CG2-CG1 4.05Å; A315-I342 PolarHBondContact O-N 2.82Å; D316-I342 HydrophobicContact CB-CD1 4.49Å; E317-I342 CarbonylContact C-O 3.51Å; E317-I342 VanDerWaalsContact C-O 3.25Å; E317-I342 WeakPolarHBondContact CA-O 3.23Å; E317-I342 WeakPolarHBondContact CB-O 3.37Å; E317-I342 PolarHBondContact N-O 2.76Å; V318-I342 HydrophobicContact CG2-CB 4.24Å; V318-I342 HydrophobicContact CG2-CG2 3.59Å; V318-I342 PolarHBondContact N-O 3.05Å; I342-A356 WeakPolarHBondContact CA-O 3.31Å; I342-V357 HydrophobicContact CG1-CG2 4.46Å
343	L	98.9	Very high	98.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	151.2	175.9	-57.9	177.9	0	0	0	110	I180 F184 E317 L322 L329 V341 L347 S355 A356 L358	I180-L343 HydrophobicContact CD1-CD1 4.33Å; F184-L343 HydrophobicContact CD2-CD1 4.05Å; F184-L343 HydrophobicContact CE1-CD1 4.39Å; F184-L343 HydrophobicContact CE2-CD1 3.71Å; F184-L343 HydrophobicContact CZ-CD1 3.9Å; E317-L343 HydrophobicContact CB-CD2 3.83Å; L322-L343 HydrophobicContact CD2-CD1 4.36Å; L322-L343 HydrophobicContact CD2-CD2 4.46Å; L329-L343 HydrophobicContact CD2-CD2 3.68Å; V341-L343 HydrophobicContact CG2-CD2 3.95Å; V341-L343 HydrophobicContact CG2-CG 4.33Å; L343-L347 HydrophobicContact CB-CD2 4.28Å; L343-S355 CarbonylContact O-C 3.58Å; L343-S355 WeakPolarHBondContact O-CA 3.46Å; L343-S355 WeakPolarHBondContact O-CB 3.49Å; L343-A356 HydrophobicContact CB-CB 4.46Å; L343-A356 PolarHBondContact N-O 3.16Å; L343-A356 PolarHBondContact O-N 3.18Å; L343-L358 HydrophobicContact CD1-CD1 3.68Å; L343-L358 HydrophobicContact CG-CD1 4.12Å
344	G	98.7	Very high	98.6	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.163	C	C	.	.			trans	-168.6	-154	177.6	0	0	0	0	0	110.5	A346 L347 V354	G344-A346 PolarHBondContact O-N 3.4Å; G344-L347 WeakPolarHBondContact O-CB 3.43Å; G344-L347 PolarHBondContact O-N 3.4Å; G344-V354 WeakPolarHBondContact CA-O 3.32Å
345	K	98.7	Very high	98.6	Very high	55 Å²	55	25 Å²	25	24%	0.239	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	47.7	-99.7	172.4	-70.2	-176.6	177.8	173.7	0	112.8	Y138 A140 V318 Q319 L347 S348	Y138-K345 WeakPolarHBondContact O-CD 3.45Å; Y138-K345 PolarHBondContact O-NZ 3.46Å; Y138-K345 VanDerWaalsContact O-NZ 3.09Å; A140-K345 HydrophobicContact CB-CB 3.89Å; A140-K345 HydrophobicContact CB-CG 4.33Å; V318-K345 HydrophobicContact CG1-CB 4.42Å; V318-K345 HydrophobicContact CG1-CD 3.89Å; V318-K345 HydrophobicContact CG1-CG 3.71Å; V318-K345 WeakPolarHBondContact O-CB 3.35Å; V318-K345 WeakPolarHBondContact O-CD 3.45Å; Q319-K345 HydrophobicContact CB-CD 4.39Å; K345-L347 PolarHBondContact O-N 2.94Å; K345-S348 PolarHBondContact O-N 3.44Å; K345-S348 PolarHBondContact O-OG 3.31Å
346	A	98.8	Very high	98.6	Very high	3 Å²	3	21.6 Å²	21.6	3%	0.025	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-64	-8.3	-179.9	0	0	0	0	0	114.7	S139 A140 N142 Q143 L322 G344 S348 G349	S139-A346 WeakPolarHBondContact O-CB 3.26Å; A140-A346 VanDerWaalsContact O-CA 3.3Å; A140-A346 WeakPolarHBondContact O-CA 3.47Å; N142-A346 HydrophobicContact CB-CB 3.75Å; N142-A346 VanDerWaalsContact ND2-CB 3.29Å; N142-A346 WeakPolarHBondContact ND2-CB 3.43Å; Q143-A346 PolarHBondContact NE2-O 2.96Å; L322-A346 HydrophobicContact CB-CB 4.08Å; L322-A346 VanDerWaalsContact CD1-C 3.41Å; L322-A346 HydrophobicContact CD1-CB 3.9Å; G344-A346 PolarHBondContact O-N 3.4Å; A346-S348 PolarHBondContact O-N 2.76Å; A346-G349 PolarHBondContact O-N 2.84Å
347	L	98.9	Very high	98.6	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-57.1	-24	175.7	-175.8	57	0	0	0	112	I180 L322 L343 G344 K345 V354 A356 A386 A389 L390	I180-L347 HydrophobicContact CD1-CD1 4Å; L322-L347 HydrophobicContact CD1-CB 3.79Å; L322-L347 HydrophobicContact CD1-CD1 4.46Å; L343-L347 HydrophobicContact CB-CD2 4.28Å; G344-L347 WeakPolarHBondContact O-CB 3.43Å; G344-L347 PolarHBondContact O-N 3.4Å; K345-L347 PolarHBondContact O-N 2.94Å; L347-V354 HydrophobicContact CD2-CB 4.43Å; L347-V354 HydrophobicContact CD2-CG1 3.86Å; L347-V354 HydrophobicContact CG-CG1 4.24Å; L347-A356 HydrophobicContact CD2-CB 3.87Å; L347-A386 HydrophobicContact CD1-CB 4.36Å; L347-A386 HydrophobicContact CG-CB 4.24Å; L347-A386 WeakPolarHBondContact O-CA 3.46Å; L347-A386 WeakPolarHBondContact O-CB 3.39Å; L347-A389 WeakPolarHBondContact O-CB 3.21Å; L347-L390 HydrophobicContact CD1-CD1 4Å; L347-L390 HydrophobicContact CD1-CD2 4.07Å; L347-L390 HydrophobicContact CD1-CG 4.13Å
348	S	98.7	Very high	98.7	Very high	3 Å²	3	16.3 Å²	16.3	2%	0.021	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-115.5	5.5	176.1	66.6	0	0	0	0	114.2	K345 A346 G350 V351 Y352	K345-S348 PolarHBondContact O-N 3.44Å; K345-S348 PolarHBondContact O-OG 3.31Å; A346-S348 PolarHBondContact O-N 2.76Å; S348-G350 PolarHBondContact O-N 3.46Å; S348-G350 PolarHBondContact OG-N 2.86Å; S348-V351 PolarHBondContact O-N 3.42Å; S348-Y352 WeakPolarHBondContact CB-O 3.34Å; S348-Y352 PolarHBondContact OG-O 3.17Å
349	G	98.3	Very high	98.7	Very high	4 Å²	4	16.2 Å²	16.2	4%	0.041	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	27.5	-168.7	0	0	0	0	0	114.8	A140 A346 V351	A140-G349 CarbonylContact O-C 3.45Å; A140-G349 VanDerWaalsContact O-C 3.23Å; A346-G349 PolarHBondContact O-N 2.84Å; G349-V351 PolarHBondContact O-N 3.37Å
350	G	97.2	Very high	98.7	Very high	43 Å²	43	16.2 Å²	16.2	44%	0.443	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.9	3.9	178.1	0	0	0	0	0	114.4	A140 S348	A140-G350 PolarHBondContact O-N 2.97Å; S348-G350 PolarHBondContact O-N 3.46Å; S348-G350 PolarHBondContact OG-N 2.86Å
351	V	97.8	Very high	98.6	Very high	44 Å²	44	18.9 Å²	18.9	27%	0.267	11%	0.112	S	C	.	.	S	Bend	trans	-85.3	-28	-176.4	175.2	0	0	0	0	112.4	I150 L154 S348 G349 V385	I150-V351 HydrophobicContact CB-CG2 4.43Å; I150-V351 HydrophobicContact CG2-CB 4.02Å; I150-V351 HydrophobicContact CG2-CG1 4.46Å; I150-V351 HydrophobicContact CG2-CG2 3.73Å; L154-V351 HydrophobicContact CB-CG1 4.17Å; L154-V351 HydrophobicContact CD1-CG1 4.44Å; L154-V351 HydrophobicContact CD2-CG1 3.6Å; L154-V351 HydrophobicContact CG-CG1 4.27Å; S348-V351 PolarHBondContact O-N 3.42Å; G349-V351 PolarHBondContact O-N 3.37Å; V351-V385 HydrophobicContact CB-CG1 4.37Å
352	Y	98.5	Very high	98.6	Very high	66 Å²	66	23.6 Å²	23.6	26%	0.259	14%	0.137	S	C	.	.	S	Bend	trans	-148.7	142.6	-175.9	-155	-86	0	0	0	111.4	L154 S348 V354 V381 A382	L154-Y352 HydrophobicContact CD1-CD2 3.79Å; L154-Y352 HydrophobicContact CD1-CE2 4.36Å; S348-Y352 WeakPolarHBondContact CB-O 3.34Å; S348-Y352 PolarHBondContact OG-O 3.17Å; Y352-V354 HydrophobicContact CD1-CG2 4.02Å; Y352-V354 PolarHBondContact O-N 3.4Å; Y352-V354 VanDerWaalsContact O-N 3.08Å; Y352-V381 HydrophobicContact CD2-CG1 3.88Å; Y352-V381 HydrophobicContact CE2-CG1 3.69Å; Y352-A382 HydrophobicContact CD1-CB 4.03Å; Y352-A382 HydrophobicContact CE1-CB 4.11Å
353	P	98.6	Very high	98.6	Very high	80 Å²	80	23.7 Å²	23.7	52%	0.519	14%	0.138	S	C	.	.			trans	-67.1	109.8	173.9	-20	33	0	0	0	111.1	N193	N193-P353 CarbonylContact O-C 3.47Å; N193-P353 WeakPolarHBondContact O-CB 3.25Å
354	V	98.6	Very high	98.6	Very high	6 Å²	6	24.4 Å²	24.4	4%	0.036	14%	0.141	C	C	.	.			trans	-138.6	134.3	175.3	-169.4	0	0	0	0	108.9	N193 G344 L347 Y352 A382 A386	N193-V354 CarbonylContact O-C 3.5Å; N193-V354 WeakPolarHBondContact O-CA 3.33Å; N193-V354 PolarHBondContact O-N 2.84Å; G344-V354 WeakPolarHBondContact CA-O 3.32Å; L347-V354 HydrophobicContact CD2-CB 4.43Å; L347-V354 HydrophobicContact CD2-CG1 3.86Å; L347-V354 HydrophobicContact CG-CG1 4.24Å; Y352-V354 HydrophobicContact CD1-CG2 4.02Å; Y352-V354 PolarHBondContact O-N 3.4Å; Y352-V354 VanDerWaalsContact O-N 3.08Å; V354-A382 HydrophobicContact CG1-CB 4.41Å; V354-A382 HydrophobicContact CG2-CB 3.54Å; V354-A386 HydrophobicContact CG1-CB 4.31Å
355	S	98.9	Very high	98.6	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	164.7	167.3	60.1	0	0	0	0	110.6	P191 M192 N193 T194 L343	P191-S355 WeakPolarHBondContact CA-O 3.4Å; M192-S355 CarbonylContact C-O 3.6Å; M192-S355 VanDerWaalsContact C-OG 3.23Å; M192-S355 VanDerWaalsContact CB-OG 3.27Å; M192-S355 WeakPolarHBondContact CB-OG 3.36Å; M192-S355 PolarHBondContact N-O 3.38Å; M192-S355 PolarHBondContact O-N 3.1Å; M192-S355 VanDerWaalsContact O-O 3.1Å; N193-S355 PolarHBondContact N-OG 3.06Å; T194-S355 VanDerWaalsContact C-OG 3.28Å; T194-S355 PolarHBondContact N-OG 3.26Å; T194-S355 WeakPolarHBondContact O-CB 3.43Å; T194-S355 PolarHBondContact O-OG 3.06Å; L343-S355 CarbonylContact O-C 3.58Å; L343-S355 WeakPolarHBondContact O-CA 3.46Å; L343-S355 WeakPolarHBondContact O-CB 3.49Å
356	A	98.8	Very high	98.6	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	141.8	-178	0	0	0	0	0	110.1	I180 V189 I342 L343 L347 L358	I180-A356 HydrophobicContact CD1-CB 4.16Å; V189-A356 HydrophobicContact CG2-CB 3.67Å; I342-A356 WeakPolarHBondContact CA-O 3.31Å; L343-A356 HydrophobicContact CB-CB 4.46Å; L343-A356 PolarHBondContact N-O 3.16Å; L343-A356 PolarHBondContact O-N 3.18Å; L347-A356 HydrophobicContact CD2-CB 3.87Å; A356-L358 HydrophobicContact CB-CD1 4.14Å
357	V	98.9	Very high	98.4	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	122.7	164.6	-175	0	0	0	0	107.7	V189 L190 G198 T201 A202 L205 L340 V341 I342 M364	V189-V357 CarbonylContact C-O 3.6Å; V189-V357 WeakPolarHBondContact CA-O 3.43Å; L190-V357 PolarHBondContact N-O 3.21Å; L190-V357 PolarHBondContact O-N 3.29Å; G198-V357 VanDerWaalsContact O-CG2 3.23Å; G198-V357 WeakPolarHBondContact O-CG2 3.27Å; T201-V357 HydrophobicContact CG2-CB 4.28Å; T201-V357 HydrophobicContact CG2-CG2 3.88Å; A202-V357 HydrophobicContact CB-CG1 4.28Å; L205-V357 HydrophobicContact CD1-CG1 3.97Å; L340-V357 HydrophobicContact CD2-CG1 4.04Å; V341-V357 WeakPolarHBondContact O-CA 3.46Å; I342-V357 HydrophobicContact CG1-CG2 4.46Å; V357-M364 VanDerWaalsContact O-CE 3.27Å; V357-M364 WeakPolarHBondContact O-CE 3.24Å
358	L	98.9	Very high	98.3	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	140	175	-60.5	92.1	0	0	0	109.9	I180 F184 Y186 K188 V189 L340 V341 L343 A356	I180-L358 HydrophobicContact CD1-CD1 4.32Å; I180-L358 HydrophobicContact CG1-CD2 4.17Å; I180-L358 HydrophobicContact CG2-CD2 4.43Å; F184-L358 HydrophobicContact CB-CD2 4.07Å; F184-L358 HydrophobicContact CD2-CD2 4.28Å; Y186-L358 HydrophobicContact CD1-CB 4.31Å; Y186-L358 HydrophobicContact CD2-CB 3.71Å; Y186-L358 HydrophobicContact CD2-CD2 4.04Å; Y186-L358 HydrophobicContact CE2-CB 4.32Å; Y186-L358 HydrophobicContact CG-CB 3.71Å; Y186-L358 HydrophobicContact CG-CD2 4.44Å; K188-L358 WeakPolarHBondContact O-CA 3.48Å; V189-L358 HydrophobicContact CB-CD2 4.37Å; V189-L358 HydrophobicContact CB-CG 4.03Å; V189-L358 HydrophobicContact CG2-CD1 4.29Å; V189-L358 HydrophobicContact CG2-CG 3.9Å; L340-L358 VanDerWaalsContact CA-O 3.26Å; L340-L358 WeakPolarHBondContact CA-O 3.48Å; V341-L358 HydrophobicContact CG1-CB 3.78Å; V341-L358 HydrophobicContact CG1-CD1 3.93Å; V341-L358 HydrophobicContact CG1-CG 4.4Å; V341-L358 PolarHBondContact N-O 2.99Å; V341-L358 PolarHBondContact O-N 3.35Å; L343-L358 HydrophobicContact CD1-CD1 3.68Å; L343-L358 HydrophobicContact CG-CD1 4.12Å; A356-L358 HydrophobicContact CB-CD1 4.14Å
359	S	98.9	Very high	98.2	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	168.4	173.7	79.6	0	0	0	0	110.2	K188 D339 M364	K188-S359 PolarHBondContact N-O 3.16Å; K188-S359 VanDerWaalsContact N-O 3.13Å; K188-S359 PolarHBondContact O-N 3.27Å; K188-S359 VanDerWaalsContact O-N 3.16Å; D339-S359 WeakPolarHBondContact O-CB 3.45Å; S359-M364 WeakPolarHBondContact OG-CB 3.17Å; S359-M364 WeakPolarHBondContact OG-CE 3.25Å; S359-M364 PolarHBondContact OG-N 2.71Å
360	D	98.9	Very high	98	Very high	37 Å²	37	43.1 Å²	43.1	20%	0.198	26%	0.264	C	S	.	.			trans	-76.3	167.5	172	-65.5	-31.1	0	0	0	112	D187 R337 D362 V363 M364	D187-D360 PolarHBondContact N-OD1 2.75Å; R337-D360 IonicContact CZ-OD1 2.73Å; R337-D360 IonicContact CZ-OD2 2.74Å; R337-D360 VanDerWaalsContact CZ-OD2 3.29Å; R337-D360 IonicContact NH1-OD2 2.69Å; R337-D360 PolarHBondContact NH1-OD2 2.68Å; R337-D360 IonicContact NH2-OD1 2.83Å; R337-D360 PolarHBondContact NH2-OD1 2.9Å; R337-D360 IonicContact NH2-OD2 2.74Å; R337-D360 PolarHBondContact NH2-OD2 3.09Å; D360-D362 VanDerWaalsContact C-N 3.31Å; D360-D362 PolarHBondContact O-N 3.4Å; D360-V363 PolarHBondContact O-N 2.73Å; D360-M364 WeakPolarHBondContact O-CB 3.47Å; D360-M364 PolarHBondContact O-N 2.8Å
361	N	98.8	Very high	98	Very high	56 Å²	56	45 Å²	45	30%	0.299	26%	0.261	S	S	.	.	H	α-helix	trans	-61.4	-35.8	-171.3	-79.9	-50.1	0	0	0	113.7	D187 K188 V363 L365	D187-N361 HydrophobicContact CB-CB 4.38Å; D187-N361 WeakPolarHBondContact CB-ND2 3.3Å; D187-N361 WeakPolarHBondContact OD2-CB 3.03Å; D187-N361 VanDerWaalsContact OD2-CG 3.29Å; D187-N361 PolarHBondContact OD2-N 2.74Å; D187-N361 PolarHBondContact OD2-ND2 2.92Å; K188-N361 WeakPolarHBondContact CE-OD1 3.38Å; K188-N361 WeakPolarHBondContact CG-OD1 3.23Å; N361-V363 PolarHBondContact O-N 3.46Å; N361-L365 HydrophobicContact CB-CD1 3.86Å; N361-L365 HydrophobicContact CB-CG 4.18Å; N361-L365 WeakPolarHBondContact O-CB 3.27Å; N361-L365 WeakPolarHBondContact O-CG 3.48Å; N361-L365 PolarHBondContact O-N 3.35Å; N361-L365 WeakPolarHBondContact OD1-CD1 3.35Å
362	D	98.1	Very high	98	Very high	99 Å²	99	44.9 Å²	44.9	53%	0.529	26%	0.257	S	S	.	.	H	α-helix	trans	-61.6	-29.8	-178.9	67.9	-36.6	0	0	0	112.6	D360 T366	D360-D362 VanDerWaalsContact C-N 3.31Å; D360-D362 PolarHBondContact O-N 3.4Å; D362-T366 WeakPolarHBondContact O-CG2 3.4Å
363	V	98.8	Very high	97.9	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.012	28%	0.276	C	S	.	.	H	α-helix	trans	-92.3	-54	172.4	-178	0	0	0	0	111.3	L205 W209 L312 L340 D360 N361 L365 T366	L205-V363 HydrophobicContact CB-CG1 4.21Å; W209-V363 HydrophobicContact CB-CG1 4.48Å; W209-V363 HydrophobicContact CG-CG2 4.33Å; L312-V363 HydrophobicContact CD1-CG1 4.19Å; L312-V363 HydrophobicContact CD1-CG2 4.14Å; L312-V363 HydrophobicContact CD2-CG2 3.7Å; L340-V363 HydrophobicContact CD1-CG1 4.18Å; L340-V363 HydrophobicContact CD2-CG1 3.99Å; L340-V363 HydrophobicContact CG-CG1 4.27Å; D360-V363 PolarHBondContact O-N 2.73Å; N361-V363 PolarHBondContact O-N 3.46Å; V363-L365 PolarHBondContact O-N 2.93Å; V363-T366 WeakPolarHBondContact O-CB 3.48Å; V363-T366 VanDerWaalsContact O-CG2 3.3Å; V363-T366 WeakPolarHBondContact O-CG2 3.5Å; V363-T366 PolarHBondContact O-N 3.36Å; V363-T366 VanDerWaalsContact O-N 3.14Å; V363-T366 PolarHBondContact O-OG1 3.01Å
364	M	98.8	Very high	97.9	Very high	15 Å²	15	42.1 Å²	42.1	7%	0.074	26%	0.259	C	S	.	.	H	α-helix	trans	-62	-43.4	-170.4	-165.8	63.2	74.9	0	0	112.1	K188 L190 L205 V357 S359 D360 T366 I367	K188-M364 HydrophobicContact CB-CB 3.8Å; K188-M364 HydrophobicContact CB-CE 4.3Å; K188-M364 HydrophobicContact CB-CG 3.57Å; K188-M364 HydrophobicContact CG-CB 4.14Å; K188-M364 HydrophobicContact CG-CG 4.13Å; L190-M364 HydrophobicContact CB-CE 4.17Å; L190-M364 HydrophobicContact CB-SD 3.91Å; L190-M364 HydrophobicContact CD1-SD 4.35Å; L205-M364 HydrophobicContact CD1-CE 4.3Å; L205-M364 HydrophobicContact CD1-SD 3.8Å; L205-M364 HydrophobicContact CD2-SD 4.09Å; V357-M364 VanDerWaalsContact O-CE 3.27Å; V357-M364 WeakPolarHBondContact O-CE 3.24Å; S359-M364 WeakPolarHBondContact OG-CB 3.17Å; S359-M364 WeakPolarHBondContact OG-CE 3.25Å; S359-M364 PolarHBondContact OG-N 2.71Å; D360-M364 WeakPolarHBondContact O-CB 3.47Å; D360-M364 PolarHBondContact O-N 2.8Å; M364-T366 PolarHBondContact O-N 2.76Å; M364-T366 VanDerWaalsContact O-N 3.15Å; M364-I367 PolarHBondContact O-N 3.42Å
365	L	98.3	Very high	97.8	Very high	84 Å²	84	46.1 Å²	46.1	44%	0.44	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	1.6	-175.4	-57.8	-177.7	0	0	0	112.7	N361 V363 I367 K368	N361-L365 HydrophobicContact CB-CD1 3.86Å; N361-L365 HydrophobicContact CB-CG 4.18Å; N361-L365 WeakPolarHBondContact O-CB 3.27Å; N361-L365 WeakPolarHBondContact O-CG 3.48Å; N361-L365 PolarHBondContact O-N 3.35Å; N361-L365 WeakPolarHBondContact OD1-CD1 3.35Å; V363-L365 PolarHBondContact O-N 2.93Å; L365-I367 VanDerWaalsContact C-N 3.29Å; L365-K368 VanDerWaalsContact O-CE 3.27Å; L365-K368 WeakPolarHBondContact O-CE 3.46Å; L365-K368 PolarHBondContact O-NZ 3.14Å
366	T	98.4	Very high	97.8	Very high	14 Å²	14	52.2 Å²	52.2	9%	0.086	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-40.8	168.6	63.2	0	0	0	0	109.9	K208 W209 V213 D362 V363 M364	K208-T366 WeakPolarHBondContact CD-O 3.41Å; K208-T366 WeakPolarHBondContact CE-O 3.28Å; W209-T366 HydrophobicContact CB-CG2 4.2Å; V213-T366 HydrophobicContact CG2-CG2 4.07Å; D362-T366 WeakPolarHBondContact O-CG2 3.4Å; V363-T366 WeakPolarHBondContact O-CB 3.48Å; V363-T366 VanDerWaalsContact O-CG2 3.3Å; V363-T366 WeakPolarHBondContact O-CG2 3.5Å; V363-T366 PolarHBondContact O-N 3.36Å; V363-T366 VanDerWaalsContact O-N 3.14Å; V363-T366 PolarHBondContact O-OG1 3.01Å; M364-T366 PolarHBondContact O-N 2.76Å; M364-T366 VanDerWaalsContact O-N 3.15Å
367	I	95.5	Very high	97.8	Very high	30 Å²	30	52.2 Å²	52.2	15%	0.154	31%	0.308	C	S	.	.	S	Bend	trans	-70.1	129.4	173.7	-70.1	178.5	0	0	0	110.3	L205 K208 M364 L365 E371 H372	L205-I367 HydrophobicContact CD2-CB 4.4Å; L205-I367 HydrophobicContact CD2-CD1 3.47Å; L205-I367 VanDerWaalsContact CD2-CD1 3.47Å; L205-I367 HydrophobicContact CD2-CG1 3.74Å; L205-I367 HydrophobicContact CG-CD1 3.68Å; L205-I367 HydrophobicContact CG-CG1 4.43Å; K208-I367 HydrophobicContact CD-CG1 3.85Å; M364-I367 PolarHBondContact O-N 3.42Å; L365-I367 VanDerWaalsContact C-N 3.29Å; I367-E371 HydrophobicContact CG2-CB 4.48Å; I367-H372 HydrophobicContact CD1-CB 4.18Å; I367-H372 HydrophobicContact CG2-CB 3.83Å
368	K	97.4	Very high	97.8	Very high	110 Å²	110	52.4 Å²	52.4	48%	0.478	31%	0.31	S	S	.	.			trans	-110	162.2	-179.1	-53.1	-54.9	-177.4	-175.5	0	111.3	L365 G370 E371	L365-K368 VanDerWaalsContact O-CE 3.27Å; L365-K368 WeakPolarHBondContact O-CE 3.46Å; L365-K368 PolarHBondContact O-NZ 3.14Å; K368-G370 PolarHBondContact O-N 3.37Å; K368-E371 HydrophobicContact CB-CG 4.31Å; K368-E371 WeakPolarHBondContact CB-OE2 3.13Å; K368-E371 PolarHBondContact N-OE2 2.99Å; K368-E371 WeakPolarHBondContact O-CB 3.27Å; K368-E371 PolarHBondContact O-N 2.97Å; K368-E371 VanDerWaalsContact O-N 3.15Å
369	P	96.8	Very high	97.8	Very high	136 Å²	136	52.6 Å²	52.6	88%	0.883	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	128.8	174.5	-28.1	36.3	0	0	0	112.1
370	G	94.3	Very high	97.7	Very high	83 Å²	83	52.6 Å²	52.6	86%	0.856	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.3	-11.1	179.9	0	0	0	0	0	116	K368	K368-G370 PolarHBondContact O-N 3.37Å
371	E	96.9	Very high	97.7	Very high	83 Å²	83	51 Å²	51	39%	0.388	30%	0.303	S	S	.	.	S	Bend	trans	-96.1	-17.1	-173.7	-57.5	-179.3	138.5	0	0	114.4	K204 K208 I367 K368	K204-E371 PolarHBondContact NZ-O 3.3Å; K208-E371 WeakPolarHBondContact CE-OE2 3.4Å; K208-E371 IonicContact NZ-OE1 3.36Å; K208-E371 PolarHBondContact NZ-OE1 2.67Å; K208-E371 IonicContact NZ-OE2 3.42Å; K208-E371 PolarHBondContact NZ-OE2 2.92Å; I367-E371 HydrophobicContact CG2-CB 4.48Å; K368-E371 HydrophobicContact CB-CG 4.31Å; K368-E371 WeakPolarHBondContact CB-OE2 3.13Å; K368-E371 PolarHBondContact N-OE2 2.99Å; K368-E371 WeakPolarHBondContact O-CB 3.27Å; K368-E371 PolarHBondContact O-N 2.97Å; K368-E371 VanDerWaalsContact O-N 3.15Å
372	H	97.8	Very high	97.7	Very high	42 Å²	42	48.5 Å²	48.5	19%	0.194	29%	0.29	C	S	.	.	S	Bend	trans	-144.7	147.9	173.2	-163.9	103.1	0	0	0	108.3	M192 T201 K204 I367	M192-H372 WeakPolarHBondContact CE-NE2 3.32Å; T201-H372 PolarHBondContact OG1-CE1 3.45Å; T201-H372 PolarHBondContact OG1-NE2 2.89Å; K204-H372 PolarHBondContact NZ-ND1 3.45Å; K204-H372 VanDerWaalsContact NZ-ND1 3.2Å; I367-H372 HydrophobicContact CD1-CB 4.18Å; I367-H372 HydrophobicContact CG2-CB 3.83Å
373	G	95.6	Very high	97.8	Very high	63 Å²	63	43.9 Å²	43.9	65%	0.649	27%	0.265	S	S	*	.			trans	-166.3	156.7	179.1	0	0	0	0	0	112.5
374	S	97.7	Very high	97.8	Very high	24 Å²	24	48.6 Å²	48.6	17%	0.168	28%	0.283	C	S	.	.			trans	-147.4	135.8	171	-176.6	0	0	0	0	108.1	N193 Y376 G377	N193-S374 PolarHBondContact ND2-OG 3.08Å; S374-Y376 VanDerWaalsContact C-N 3.33Å; S374-G377 PolarHBondContact OG-N 2.88Å
375	T	98.1	Very high	97.8	Very high	91 Å²	91	47.9 Å²	47.9	56%	0.558	28%	0.279	S	S	*	.	S	Bend	trans	-63.9	-42	177.5	-59.3	0	0	0	0	111.1	L163	L163-T375 WeakPolarHBondContact CD1-O 3.29Å; L163-T375 HydrophobicContact CD2-CG2 4.5Å
376	Y	98.4	Very high	97.8	Very high	127 Å²	127	43.9 Å²	43.9	50%	0.498	26%	0.258	S	S	.	.	S	Bend	trans	-99.5	-18.5	-174.8	-71.5	-86	0	0	0	113.6	L163 N193 S374 G378 N379	L163-Y376 HydrophobicContact CD1-CD1 3.92Å; L163-Y376 HydrophobicContact CD1-CE1 4.37Å; L163-Y376 HydrophobicContact CD2-CD1 4.01Å; L163-Y376 HydrophobicContact CD2-CE1 3.62Å; N193-Y376 WeakPolarHBondContact OD1-CB 3.5Å; N193-Y376 PolarHBondContact OD1-O 2.75Å; S374-Y376 VanDerWaalsContact C-N 3.33Å; Y376-G378 PolarHBondContact O-N 2.82Å; Y376-N379 WeakPolarHBondContact O-CB 3.5Å; Y376-N379 PolarHBondContact O-N 2.87Å; Y376-N379 PolarHBondContact O-ND2 2.87Å
377	G	98.3	Very high	97.9	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.01	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	119.3	-179.6	0	0	0	0	0	111.8	R166 P191 N193 S374	R166-G377 WeakPolarHBondContact CD-O 3.18Å; P191-G377 CarbonylContact O-C 3.56Å; P191-G377 WeakPolarHBondContact O-CA 3.28Å; N193-G377 PolarHBondContact OD1-N 3.05Å; S374-G377 PolarHBondContact OG-N 2.88Å
378	G	98.3	Very high	98	Very high	3 Å²	3	42.7 Å²	42.7	3%	0.031	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	78	23.5	-177.6	0	0	0	0	0	115.2	Y376	Y376-G378 PolarHBondContact O-N 2.82Å
379	N	98.8	Very high	98.1	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.021	23%	0.23	C	C	.	.			trans	-65.9	150.7	173.3	74.8	79.1	0	0	0	111.8	A162 L163 Y376 V381 A382 C383	A162-N379 PolarHBondContact O-OD1 3.46Å; L163-N379 HydrophobicContact CD1-CB 3.65Å; Y376-N379 WeakPolarHBondContact O-CB 3.5Å; Y376-N379 PolarHBondContact O-N 2.87Å; Y376-N379 PolarHBondContact O-ND2 2.87Å; N379-V381 VanDerWaalsContact C-N 3.3Å; N379-V381 PolarHBondContact O-N 2.82Å; N379-V381 WeakPolarHBondContact OD1-CB 3.4Å; N379-V381 PolarHBondContact OD1-N 2.86Å; N379-A382 VanDerWaalsContact ND2-CB 3.34Å; N379-A382 WeakPolarHBondContact ND2-CB 3.45Å; N379-A382 PolarHBondContact O-N 3.48Å; N379-A382 PolarHBondContact OD1-N 2.87Å; N379-C383 PolarHBondContact O-N 2.76Å; N379-C383 PolarHBondContact O-SG 3.46Å; N379-C383 VanDerWaalsContact O-SG 3.35Å
380	P	98.8	Very high	98.2	Very high	0 Å²	0	31 Å²	31	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-55.5	-38.6	-175.5	-24.4	28	0	0	0	115.1	Q157 L161 A162 N170 V172 C383 R384	Q157-P380 HydrophobicContact CG-CB 4.2Å; Q157-P380 WeakPolarHBondContact CG-O 3.27Å; L161-P380 HydrophobicContact CD2-CG 4.39Å; L161-P380 HydrophobicContact CG-CG 4.3Å; L161-P380 WeakPolarHBondContact O-CB 3.21Å; A162-P380 WeakPolarHBondContact O-CD 3.42Å; N170-P380 HydrophobicContact CB-CG 3.85Å; V172-P380 HydrophobicContact CB-CB 4.15Å; V172-P380 HydrophobicContact CG2-CB 4.04Å; P380-C383 PolarHBondContact O-N 3.21Å; P380-R384 PolarHBondContact O-N 2.93Å
381	V	98.9	Very high	98.4	Very high	4 Å²	4	29.9 Å²	29.9	2%	0.024	16%	0.16	C	C	.	.	H	α-helix	trans	-65.2	-50.9	-179.9	166.1	0	0	0	0	110.8	L154 Q157 A158 A162 Y352 N379 C383 R384 V385	L154-V381 HydrophobicContact CD1-CG1 3.47Å; L154-V381 VanDerWaalsContact CD1-CG1 3.47Å; Q157-V381 HydrophobicContact CB-CG2 4.16Å; Q157-V381 HydrophobicContact CG-CB 4.41Å; Q157-V381 HydrophobicContact CG-CG2 3.83Å; A158-V381 HydrophobicContact CB-CG2 4.11Å; A162-V381 HydrophobicContact CB-CG2 4.07Å; Y352-V381 HydrophobicContact CD2-CG1 3.88Å; Y352-V381 HydrophobicContact CE2-CG1 3.69Å; N379-V381 VanDerWaalsContact C-N 3.3Å; N379-V381 PolarHBondContact O-N 2.82Å; N379-V381 WeakPolarHBondContact OD1-CB 3.4Å; N379-V381 PolarHBondContact OD1-N 2.86Å; V381-C383 VanDerWaalsContact C-N 3.28Å; V381-C383 PolarHBondContact O-N 2.85Å; V381-R384 PolarHBondContact O-N 2.68Å; V381-V385 HydrophobicContact CG1-CG2 4.35Å; V381-V385 WeakPolarHBondContact O-CB 3.42Å; V381-V385 VanDerWaalsContact O-CG2 3.28Å; V381-V385 WeakPolarHBondContact O-CG2 3.45Å; V381-V385 PolarHBondContact O-N 2.64Å
382	A	98.8	Very high	98.5	Very high	4 Å²	4	26 Å²	26	3%	0.033	14%	0.142	C	C	.	.	H	α-helix	trans	-54.1	-46.3	175.2	0	0	0	0	0	111.4	Y352 V354 N379 V385 A386	Y352-A382 HydrophobicContact CD1-CB 4.03Å; Y352-A382 HydrophobicContact CE1-CB 4.11Å; V354-A382 HydrophobicContact CG1-CB 4.41Å; V354-A382 HydrophobicContact CG2-CB 3.54Å; N379-A382 VanDerWaalsContact ND2-CB 3.34Å; N379-A382 WeakPolarHBondContact ND2-CB 3.45Å; N379-A382 PolarHBondContact O-N 3.48Å; N379-A382 PolarHBondContact OD1-N 2.87Å; A382-V385 PolarHBondContact O-N 2.81Å; A382-A386 VanDerWaalsContact O-CB 3.27Å; A382-A386 WeakPolarHBondContact O-CB 3.25Å; A382-A386 PolarHBondContact O-N 2.9Å
383	C	98.9	Very high	98.6	Very high	2 Å²	2	24.2 Å²	24.2	1%	0.014	13%	0.134	C	C	.	.	H	α-helix	trans	-62.6	-47.2	-179.8	-68.8	0	0	0	0	112.8	V172 Y176 N379 P380 V381 A386 I387	V172-C383 HydrophobicContact CB-CB 4.42Å; V172-C383 HydrophobicContact CG1-CB 3.51Å; Y176-C383 HydrophobicContact CD1-CB 4.38Å; Y176-C383 HydrophobicContact CG-CB 3.98Å; N379-C383 PolarHBondContact O-N 2.76Å; N379-C383 PolarHBondContact O-SG 3.46Å; N379-C383 VanDerWaalsContact O-SG 3.35Å; P380-C383 PolarHBondContact O-N 3.21Å; V381-C383 VanDerWaalsContact C-N 3.28Å; V381-C383 PolarHBondContact O-N 2.85Å; C383-A386 PolarHBondContact O-N 2.79Å; C383-I387 VanDerWaalsContact O-CG1 3.32Å; C383-I387 WeakPolarHBondContact O-CG1 3.31Å; C383-I387 PolarHBondContact O-N 3.49Å
384	R	98.8	Very high	98.7	Very high	100 Å²	100	24.3 Å²	24.3	38%	0.377	12%	0.117	S	C	.	.	H	α-helix	trans	-64.7	-41.4	176.4	-77.5	-51.8	-175.8	177.8	-6.7	112.8	Q157 V172 P380 V381 A386 A388	Q157-R384 HydrophobicContact CB-CB 4.02Å; Q157-R384 HydrophobicContact CB-CG 3.93Å; Q157-R384 HydrophobicContact CG-CB 4.09Å; Q157-R384 HydrophobicContact CG-CG 3.72Å; V172-R384 HydrophobicContact CG1-CG 3.67Å; V172-R384 HydrophobicContact CG2-CG 4.34Å; P380-R384 PolarHBondContact O-N 2.93Å; V381-R384 PolarHBondContact O-N 2.68Å; R384-A386 VanDerWaalsContact C-N 3.31Å; R384-A388 WeakPolarHBondContact O-CB 3.37Å; R384-A388 PolarHBondContact O-N 3.11Å
385	V	98.9	Very high	98.8	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61.5	-43.8	176.9	168	0	0	0	0	110.2	I150 L154 V351 V381 A382 A388 A389	I150-V385 HydrophobicContact CG2-CG1 3.84Å; L154-V385 HydrophobicContact CB-CG2 3.73Å; L154-V385 HydrophobicContact CD1-CG2 3.9Å; L154-V385 HydrophobicContact CG-CG2 4.46Å; V351-V385 HydrophobicContact CB-CG1 4.37Å; V381-V385 HydrophobicContact CG1-CG2 4.35Å; V381-V385 WeakPolarHBondContact O-CB 3.42Å; V381-V385 VanDerWaalsContact O-CG2 3.28Å; V381-V385 WeakPolarHBondContact O-CG2 3.45Å; V381-V385 PolarHBondContact O-N 2.64Å; A382-V385 PolarHBondContact O-N 2.81Å; V385-A388 PolarHBondContact O-N 2.73Å; V385-A389 VanDerWaalsContact O-CB 3.29Å; V385-A389 WeakPolarHBondContact O-CB 3.28Å; V385-A389 PolarHBondContact O-N 3.1Å
386	A	98.9	Very high	98.8	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-67	-43.3	-179.8	0	0	0	0	0	113	Y176 L347 V354 A382 C383 R384 A388 A389 L390	Y176-A386 HydrophobicContact CD2-CB 4.08Å; Y176-A386 HydrophobicContact CE2-CB 3.65Å; L347-A386 HydrophobicContact CD1-CB 4.36Å; L347-A386 HydrophobicContact CG-CB 4.24Å; L347-A386 WeakPolarHBondContact O-CA 3.46Å; L347-A386 WeakPolarHBondContact O-CB 3.39Å; V354-A386 HydrophobicContact CG1-CB 4.31Å; A382-A386 VanDerWaalsContact O-CB 3.27Å; A382-A386 WeakPolarHBondContact O-CB 3.25Å; A382-A386 PolarHBondContact O-N 2.9Å; C383-A386 PolarHBondContact O-N 2.79Å; R384-A386 VanDerWaalsContact C-N 3.31Å; A386-A388 PolarHBondContact O-N 3.18Å; A386-A389 PolarHBondContact O-N 3.49Å; A386-L390 WeakPolarHBondContact O-CB 3.47Å; A386-L390 VanDerWaalsContact O-CG 3.29Å; A386-L390 WeakPolarHBondContact O-CG 3.42Å; A386-L390 PolarHBondContact O-N 3.14Å
387	I	98.9	Very high	98.8	Very high	14 Å²	14	28.8 Å²	28.8	7%	0.072	13%	0.132	C	C	.	.	H	α-helix	trans	-56.3	-52.1	172.7	-66.3	167	0	0	0	109.7	Y176 Y179 C383 A389 L390 E391	Y176-I387 HydrophobicContact CD2-CG1 4.02Å; Y179-I387 HydrophobicContact CD1-CG1 4.45Å; Y179-I387 HydrophobicContact CD2-CG2 4.39Å; Y179-I387 HydrophobicContact CE2-CG2 4.44Å; Y179-I387 HydrophobicContact CG-CG1 4.41Å; Y179-I387 HydrophobicContact CG-CG2 4.47Å; C383-I387 VanDerWaalsContact O-CG1 3.32Å; C383-I387 WeakPolarHBondContact O-CG1 3.31Å; C383-I387 PolarHBondContact O-N 3.49Å; I387-A389 VanDerWaalsContact C-N 3.29Å; I387-A389 PolarHBondContact O-N 3.12Å; I387-L390 PolarHBondContact O-N 2.95Å; I387-E391 HydrophobicContact CG2-CG 4.22Å; I387-E391 WeakPolarHBondContact CG2-OE1 3.49Å; I387-E391 WeakPolarHBondContact O-CG 3.39Å; I387-E391 PolarHBondContact O-N 3.26Å
388	A	98.9	Very high	98.8	Very high	6 Å²	6	28.9 Å²	28.9	5%	0.05	13%	0.132	C	C	.	.	H	α-helix	trans	-60.5	-38.2	-179.1	0	0	0	0	0	112.7	A153 R384 V385 A386 E391 V392	A153-A388 HydrophobicContact CB-CB 3.61Å; R384-A388 WeakPolarHBondContact O-CB 3.37Å; R384-A388 PolarHBondContact O-N 3.11Å; V385-A388 PolarHBondContact O-N 2.73Å; A386-A388 PolarHBondContact O-N 3.18Å; A388-E391 PolarHBondContact O-N 3.19Å; A388-V392 VanDerWaalsContact O-CG2 3.27Å; A388-V392 WeakPolarHBondContact O-CG2 3.46Å; A388-V392 PolarHBondContact O-N 2.8Å
389	A	98.9	Very high	98.9	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-67.1	-38.6	177.9	0	0	0	0	0	112.7	Q143 I150 L347 V385 A386 I387 M393	Q143-A389 PolarHBondContact NE2-O 3.01Å; I150-A389 HydrophobicContact CD1-CB 3.84Å; I150-A389 HydrophobicContact CG1-CB 4.38Å; L347-A389 WeakPolarHBondContact O-CB 3.21Å; V385-A389 VanDerWaalsContact O-CB 3.29Å; V385-A389 WeakPolarHBondContact O-CB 3.28Å; V385-A389 PolarHBondContact O-N 3.1Å; A386-A389 PolarHBondContact O-N 3.49Å; I387-A389 VanDerWaalsContact C-N 3.29Å; I387-A389 PolarHBondContact O-N 3.12Å; A389-M393 PolarHBondContact O-N 2.78Å
390	L	98.9	Very high	98.9	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-73	-36.5	175	-68	171.4	0	0	0	112.1	Y179 I180 M183 F184 L322 L347 A386 I387 M393 E394	Y179-L390 HydrophobicContact CD1-CD1 4.04Å; Y179-L390 HydrophobicContact CE1-CB 3.65Å; Y179-L390 HydrophobicContact CE1-CD1 3.84Å; Y179-L390 HydrophobicContact CE1-CG 4.41Å; I180-L390 HydrophobicContact CD1-CD1 4.35Å; I180-L390 HydrophobicContact CG1-CD1 4.15Å; M183-L390 HydrophobicContact CE-CB 4.2Å; M183-L390 HydrophobicContact SD-CB 4.09Å; M183-L390 HydrophobicContact SD-CD1 4.2Å; M183-L390 HydrophobicContact SD-CD2 3.98Å; M183-L390 HydrophobicContact SD-CG 4.32Å; F184-L390 HydrophobicContact CE2-CD2 4.25Å; F184-L390 HydrophobicContact CZ-CD2 4.19Å; L322-L390 HydrophobicContact CD2-CD2 3.72Å; L347-L390 HydrophobicContact CD1-CD1 4Å; L347-L390 HydrophobicContact CD1-CD2 4.07Å; L347-L390 HydrophobicContact CD1-CG 4.13Å; A386-L390 WeakPolarHBondContact O-CB 3.47Å; A386-L390 VanDerWaalsContact O-CG 3.29Å; A386-L390 WeakPolarHBondContact O-CG 3.42Å; A386-L390 PolarHBondContact O-N 3.14Å; I387-L390 PolarHBondContact O-N 2.95Å; L390-M393 HydrophobicContact CD2-CE 4.19Å; L390-M393 WeakPolarHBondContact O-CB 3.32Å; L390-M393 PolarHBondContact O-N 2.85Å; L390-E394 PolarHBondContact O-N 2.92Å
391	E	98.9	Very high	98.9	Very high	59 Å²	59	36 Å²	36	28%	0.276	17%	0.168	S	C	.	.	H	α-helix	trans	-61.4	-46.3	172.8	-72.8	174.1	171.8	0	0	111.2	K149 Y179 I387 A388 M393 E394 E395	K149-E391 WeakPolarHBondContact CE-OE2 3.49Å; K149-E391 IonicContact NZ-OE2 3.14Å; K149-E391 PolarHBondContact NZ-OE2 3.49Å; Y179-E391 HydrophobicContact CE2-CG 4.32Å; Y179-E391 WeakPolarHBondContact OH-CG 3.27Å; I387-E391 HydrophobicContact CG2-CG 4.22Å; I387-E391 WeakPolarHBondContact CG2-OE1 3.49Å; I387-E391 WeakPolarHBondContact O-CG 3.39Å; I387-E391 PolarHBondContact O-N 3.26Å; A388-E391 PolarHBondContact O-N 3.19Å; E391-M393 VanDerWaalsContact C-N 3.25Å; E391-M393 PolarHBondContact O-N 2.71Å; E391-E394 PolarHBondContact O-N 3.28Å; E391-E395 VanDerWaalsContact O-CB 3.31Å; E391-E395 WeakPolarHBondContact O-CB 3.35Å; E391-E395 VanDerWaalsContact O-CG 3.26Å; E391-E395 WeakPolarHBondContact O-CG 3.45Å; E391-E395 PolarHBondContact O-N 3Å
392	V	98.9	Very high	98.9	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-57.1	-41.6	175.4	169.6	0	0	0	0	111.1	Q143 H147 K149 I150 A388 E394 E396 L398	Q143-V392 HydrophobicContact CB-CG1 3.95Å; Q143-V392 HydrophobicContact CG-CB 4.16Å; Q143-V392 HydrophobicContact CG-CG1 3.72Å; H147-V392 WeakPolarHBondContact CE1-CG2 3.39Å; K149-V392 HydrophobicContact CB-CG2 4Å; K149-V392 HydrophobicContact CD-CG2 3.84Å; K149-V392 HydrophobicContact CG-CG2 4.17Å; I150-V392 HydrophobicContact CG1-CG2 4.23Å; A388-V392 VanDerWaalsContact O-CG2 3.27Å; A388-V392 WeakPolarHBondContact O-CG2 3.46Å; A388-V392 PolarHBondContact O-N 2.8Å; V392-E394 VanDerWaalsContact C-N 3.32Å; V392-E394 PolarHBondContact O-N 3.01Å; V392-E396 HydrophobicContact CG1-CG 4.33Å; V392-E396 WeakPolarHBondContact O-CB 3.28Å; V392-E396 PolarHBondContact O-N 3.45Å; V392-L398 HydrophobicContact CG1-CD1 4.45Å
393	M	98.8	Very high	98.9	Very high	5 Å²	5	38.5 Å²	38.5	3%	0.025	18%	0.179	C	C	.	.	H	α-helix	trans	-57	-44.6	178.5	-177.2	-173.2	72.2	0	0	112.6	M183 L322 A323 R328 A389 L390 E391 K397 L398	M183-M393 HydrophobicContact SD-CE 4.13Å; L322-M393 VanDerWaalsContact CA-SD 3.56Å; L322-M393 HydrophobicContact CB-SD 4.02Å; L322-M393 HydrophobicContact CD2-SD 4.33Å; A323-M393 HydrophobicContact CB-CG 3.72Å; A323-M393 HydrophobicContact CB-SD 3.95Å; R328-M393 HydrophobicContact CG-CE 4.4Å; A389-M393 PolarHBondContact O-N 2.78Å; L390-M393 HydrophobicContact CD2-CE 4.19Å; L390-M393 WeakPolarHBondContact O-CB 3.32Å; L390-M393 PolarHBondContact O-N 2.85Å; E391-M393 VanDerWaalsContact C-N 3.25Å; E391-M393 PolarHBondContact O-N 2.71Å; M393-K397 PolarHBondContact O-N 2.85Å; M393-L398 HydrophobicContact CB-CD1 4.39Å; M393-L398 HydrophobicContact CG-CB 4.35Å; M393-L398 PolarHBondContact O-N 2.9Å
394	E	98.8	Very high	98.9	Very high	65 Å²	65	43.9 Å²	43.9	30%	0.304	20%	0.199	S	C	.	.	H	α-helix	trans	-78.9	-46.6	-179.6	-66.3	-65	138.5	0	0	112.6	M183 R328 L390 E391 V392 E396 K397	M183-E394 HydrophobicContact CE-CG 3.64Å; R328-E394 IonicContact CZ-OE1 2.68Å; R328-E394 IonicContact CZ-OE2 3.48Å; R328-E394 IonicContact NE-OE1 3.73Å; R328-E394 PolarHBondContact NE-OE1 2.76Å; R328-E394 IonicContact NE-OE2 2.67Å; R328-E394 PolarHBondContact NE-OE2 3.49Å; R328-E394 IonicContact NH2-OE1 3.55Å; R328-E394 IonicContact NH2-OE2 3.87Å; R328-E394 PolarHBondContact NH2-OE2 3.15Å; L390-E394 PolarHBondContact O-N 2.92Å; E391-E394 PolarHBondContact O-N 3.28Å; V392-E394 VanDerWaalsContact C-N 3.32Å; V392-E394 PolarHBondContact O-N 3.01Å; E394-E396 VanDerWaalsContact C-N 3.31Å; E394-E396 PolarHBondContact O-N 2.99Å; E394-K397 PolarHBondContact O-N 2.84Å
395	E	98.8	Very high	98.9	Very high	119 Å²	119	39.2 Å²	39.2	56%	0.556	18%	0.181	S	C	*	.	H	α-helix	trans	-62.3	-38.6	-177.2	-72.3	170.1	178.7	0	0	112	K149 E391	K149-E395 IonicContact NZ-OE1 2.8Å; K149-E395 PolarHBondContact NZ-OE1 2.8Å; K149-E395 IonicContact NZ-OE2 3.91Å; K149-E395 PolarHBondContact NZ-OE2 2.74Å; E391-E395 VanDerWaalsContact O-CB 3.31Å; E391-E395 WeakPolarHBondContact O-CB 3.35Å; E391-E395 VanDerWaalsContact O-CG 3.26Å; E391-E395 WeakPolarHBondContact O-CG 3.45Å; E391-E395 PolarHBondContact O-N 3Å
396	E	98.8	Very high	98.9	Very high	85 Å²	85	39.2 Å²	39.2	40%	0.397	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	3.7	-179.4	-59.7	-170	-166.2	0	0	113.6	H147 V392 E394 L398 V472	H147-E396 IonicContact CE1-OE1 2.73Å; H147-E396 IonicContact NE2-OE1 2.77Å; H147-E396 PolarHBondContact NE2-OE1 3.14Å; V392-E396 HydrophobicContact CG1-CG 4.33Å; V392-E396 WeakPolarHBondContact O-CB 3.28Å; V392-E396 PolarHBondContact O-N 3.45Å; E394-E396 VanDerWaalsContact C-N 3.31Å; E394-E396 PolarHBondContact O-N 2.99Å; E396-L398 VanDerWaalsContact C-N 3.29Å; E396-L398 HydrophobicContact CB-CD2 3.73Å; E396-L398 HydrophobicContact CB-CG 4.19Å; E396-L398 PolarHBondContact O-N 3.05Å; E396-V472 WeakPolarHBondContact OE2-CG1 3.46Å
397	K	98.8	Very high	98.9	Very high	132 Å²	132	43 Å²	43	57%	0.574	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.8	46.6	177.2	-58.8	-174.1	-178.6	-174.8	0	112.3	M393 E394 A399 E400 N401	M393-K397 PolarHBondContact O-N 2.85Å; E394-K397 PolarHBondContact O-N 2.84Å; K397-A399 PolarHBondContact O-N 3.06Å; K397-E400 VanDerWaalsContact C-OE2 3.26Å; K397-E400 VanDerWaalsContact CA-OE2 3.28Å; K397-E400 WeakPolarHBondContact CA-OE2 3.46Å; K397-E400 HydrophobicContact CB-CB 4.37Å; K397-E400 WeakPolarHBondContact CB-OE2 3.25Å; K397-E400 PolarHBondContact O-N 3.33Å; K397-N401 PolarHBondContact O-N 3.41Å
398	L	98.9	Very high	98.9	Very high	3 Å²	3	44.2 Å²	44.2	2%	0.016	21%	0.205	C	C	.	.	H	α-helix	trans	-65.1	-29.5	-172.4	-62.9	-169.8	0	0	0	112.2	Q143 A323 V392 M393 E396 A402 L471 V472	Q143-L398 HydrophobicContact CG-CD1 4.02Å; A323-L398 HydrophobicContact CB-CB 3.87Å; V392-L398 HydrophobicContact CG1-CD1 4.45Å; M393-L398 HydrophobicContact CB-CD1 4.39Å; M393-L398 HydrophobicContact CG-CB 4.35Å; M393-L398 PolarHBondContact O-N 2.9Å; E396-L398 VanDerWaalsContact C-N 3.29Å; E396-L398 HydrophobicContact CB-CD2 3.73Å; E396-L398 HydrophobicContact CB-CG 4.19Å; E396-L398 PolarHBondContact O-N 3.05Å; L398-A402 WeakPolarHBondContact O-CB 3.41Å; L398-A402 PolarHBondContact O-N 3.22Å; L398-L471 HydrophobicContact CB-CB 4.06Å; L398-L471 HydrophobicContact CB-CD1 4.11Å; L398-L471 HydrophobicContact CD1-CB 4.31Å; L398-L471 HydrophobicContact CD2-CB 4.27Å; L398-L471 HydrophobicContact CG-CB 4.45Å; L398-V472 HydrophobicContact CD2-CG1 3.85Å
399	A	98.9	Very high	98.9	Very high	15 Å²	15	44 Å²	44	12%	0.124	20%	0.203	C	C	.	.	H	α-helix	trans	-67	-45.6	177	0	0	0	0	0	110.8	A323 G326 K397 A402 Q403	A323-A399 HydrophobicContact CB-CB 3.88Å; G326-A399 CarbonylContact C-O 3.54Å; G326-A399 VanDerWaalsContact CA-O 3.23Å; G326-A399 WeakPolarHBondContact CA-O 3.41Å; K397-A399 PolarHBondContact O-N 3.06Å; A399-A402 PolarHBondContact O-N 2.92Å; A399-Q403 WeakPolarHBondContact O-CB 3.12Å; A399-Q403 PolarHBondContact O-N 2.99Å
400	E	98.9	Very high	98.8	Very high	113 Å²	113	44.6 Å²	44.6	53%	0.528	21%	0.205	S	C	.	.	H	α-helix	trans	-63.7	-43.1	176.7	-63.8	91.3	150	0	0	111.4	K397 Q403 R404	K397-E400 VanDerWaalsContact C-OE2 3.26Å; K397-E400 VanDerWaalsContact CA-OE2 3.28Å; K397-E400 WeakPolarHBondContact CA-OE2 3.46Å; K397-E400 HydrophobicContact CB-CB 4.37Å; K397-E400 WeakPolarHBondContact CB-OE2 3.25Å; K397-E400 PolarHBondContact O-N 3.33Å; E400-Q403 PolarHBondContact O-N 2.72Å; E400-R404 WeakPolarHBondContact O-CB 3.29Å; E400-R404 PolarHBondContact O-N 3Å
401	N	98.9	Very high	98.8	Very high	28 Å²	28	47.2 Å²	47.2	15%	0.15	22%	0.222	C	C	.	.	H	α-helix	trans	-66	-43.9	177.5	-164.2	52.5	0	0	0	111.4	K397 Q403 R404 M405 L471 I473	K397-N401 PolarHBondContact O-N 3.41Å; N401-Q403 VanDerWaalsContact C-N 3.31Å; N401-Q403 PolarHBondContact O-N 3.21Å; N401-R404 PolarHBondContact O-N 2.89Å; N401-R404 PolarHBondContact OD1-NH2 3.34Å; N401-M405 VanDerWaalsContact O-CB 3.25Å; N401-M405 WeakPolarHBondContact O-CB 3.26Å; N401-M405 VanDerWaalsContact O-CG 3.27Å; N401-M405 WeakPolarHBondContact O-CG 3.36Å; N401-M405 PolarHBondContact O-N 3.39Å; N401-M405 WeakPolarHBondContact OD1-CG 3.44Å; N401-L471 PolarHBondContact ND2-O 2.65Å; N401-I473 PolarHBondContact ND2-O 3.18Å
402	A	98.9	Very high	98.8	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-59.5	-40.3	176.4	0	0	0	0	0	112.4	A323 L398 A399 G406 G428 L429 L471	A323-A402 VanDerWaalsContact O-CB 3.24Å; A323-A402 WeakPolarHBondContact O-CB 3.45Å; L398-A402 WeakPolarHBondContact O-CB 3.41Å; L398-A402 PolarHBondContact O-N 3.22Å; A399-A402 PolarHBondContact O-N 2.92Å; A402-G406 WeakPolarHBondContact O-CA 3.47Å; A402-G406 PolarHBondContact O-N 3.42Å; A402-G428 CarbonylContact O-C 3.23Å; A402-G428 VanDerWaalsContact O-C 3.31Å; A402-G428 VanDerWaalsContact O-CA 3.22Å; A402-G428 WeakPolarHBondContact O-CA 3.12Å; A402-L429 HydrophobicContact CB-CD1 4.43Å; A402-L429 HydrophobicContact CB-CG 4.43Å; A402-L471 HydrophobicContact CB-CD1 4.29Å; A402-L471 HydrophobicContact CB-CD2 3.9Å
403	Q	98.9	Very high	98.8	Very high	61 Å²	61	45.9 Å²	45.9	29%	0.285	22%	0.216	S	C	.	.	H	α-helix	trans	-61.2	-51	175	179.3	61.2	32.8	0	0	111.1	A399 E400 N401 E407	A399-Q403 WeakPolarHBondContact O-CB 3.12Å; A399-Q403 PolarHBondContact O-N 2.99Å; E400-Q403 PolarHBondContact O-N 2.72Å; N401-Q403 VanDerWaalsContact C-N 3.31Å; N401-Q403 PolarHBondContact O-N 3.21Å; Q403-E407 PolarHBondContact O-N 2.58Å; Q403-E407 VanDerWaalsContact O-N 3.17Å
404	R	98.8	Very high	98.8	Very high	116 Å²	116	51.7 Å²	51.7	44%	0.438	24%	0.237	S	C	.	.	H	α-helix	trans	-65.9	-51.3	-176.2	-171.5	-179.6	68	94.4	4.6	112.1	E400 N401 G406 E407 L408 E475	E400-R404 WeakPolarHBondContact O-CB 3.29Å; E400-R404 PolarHBondContact O-N 3Å; N401-R404 PolarHBondContact O-N 2.89Å; N401-R404 PolarHBondContact OD1-NH2 3.34Å; R404-G406 VanDerWaalsContact C-N 3.34Å; R404-E407 PolarHBondContact O-N 3.37Å; R404-L408 PolarHBondContact O-N 3.08Å; R404-E475 IonicContact CZ-OE2 2.72Å; R404-E475 IonicContact NH1-OE2 3.5Å; R404-E475 PolarHBondContact NH1-OE2 3.1Å
405	M	98.9	Very high	98.7	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-66.3	-36.6	179.2	-66.2	-61.1	81.1	0	0	112	N401 E407 L408 L409 L429 I473 E475 L478	N401-M405 VanDerWaalsContact O-CB 3.25Å; N401-M405 WeakPolarHBondContact O-CB 3.26Å; N401-M405 VanDerWaalsContact O-CG 3.27Å; N401-M405 WeakPolarHBondContact O-CG 3.36Å; N401-M405 PolarHBondContact O-N 3.39Å; N401-M405 WeakPolarHBondContact OD1-CG 3.44Å; M405-E407 PolarHBondContact O-N 3.23Å; M405-L408 HydrophobicContact CE-CD2 4.09Å; M405-L408 PolarHBondContact O-N 2.9Å; M405-L409 WeakPolarHBondContact O-CB 3.37Å; M405-L409 PolarHBondContact O-N 2.9Å; M405-L429 HydrophobicContact CB-CD1 3.96Å; M405-L429 HydrophobicContact CB-CD2 3.93Å; M405-L429 HydrophobicContact CB-CG 4.12Å; M405-I473 HydrophobicContact CG-CG2 4.33Å; M405-E475 HydrophobicContact CE-CB 4Å; M405-E475 HydrophobicContact CE-CG 4.09Å; M405-E475 HydrophobicContact SD-CB 4.11Å; M405-L478 HydrophobicContact CB-CD2 3.81Å; M405-L478 HydrophobicContact CG-CD2 4.31Å; M405-L478 VanDerWaalsContact O-CD2 3.31Å; M405-L478 WeakPolarHBondContact O-CD2 3.49Å; M405-L478 HydrophobicContact SD-CB 4.34Å; M405-L478 HydrophobicContact SD-CD2 3.77Å
406	G	98.8	Very high	98.7	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59.5	-43.5	173.5	0	0	0	0	0	113.9	A402 R404 R410 G428	A402-G406 WeakPolarHBondContact O-CA 3.47Å; A402-G406 PolarHBondContact O-N 3.42Å; R404-G406 VanDerWaalsContact C-N 3.34Å; G406-R410 WeakPolarHBondContact O-CG 3.5Å; G406-R410 PolarHBondContact O-N 3.48Å; G406-R410 PolarHBondContact O-NH1 3.17Å; G406-G428 WeakPolarHBondContact CA-O 3.28Å
407	E	98.8	Very high	98.6	Very high	80 Å²	80	46.9 Å²	46.9	37%	0.374	22%	0.216	S	C	.	.	H	α-helix	trans	-69.4	-40.8	178.7	-167.2	55.3	-142.5	0	0	112.2	Q403 R404 M405 R410 T411 R414	Q403-E407 PolarHBondContact O-N 2.58Å; Q403-E407 VanDerWaalsContact O-N 3.17Å; R404-E407 PolarHBondContact O-N 3.37Å; M405-E407 PolarHBondContact O-N 3.23Å; E407-R410 IonicContact OE2-CZ 3.7Å; E407-R410 IonicContact OE2-NE 3.79Å; E407-R410 IonicContact OE2-NH2 2.79Å; E407-R410 PolarHBondContact OE2-NH2 2.88Å; E407-T411 VanDerWaalsContact O-CB 3.29Å; E407-T411 WeakPolarHBondContact O-CB 3.31Å; E407-T411 PolarHBondContact O-N 2.89Å; E407-T411 PolarHBondContact O-OG1 3.39Å; E407-R414 IonicContact OE1-NH1 3.47Å; E407-R414 PolarHBondContact OE1-NH1 2.85Å
408	L	98.8	Very high	98.5	Very high	39 Å²	39	48.8 Å²	48.8	20%	0.204	22%	0.224	C	C	.	.	H	α-helix	trans	-58.6	-51.3	173.1	177.5	57.2	0	0	0	111	R404 M405 R410 T411 E412 E475 L478 I482	R404-L408 PolarHBondContact O-N 3.08Å; M405-L408 HydrophobicContact CE-CD2 4.09Å; M405-L408 PolarHBondContact O-N 2.9Å; L408-R410 PolarHBondContact O-N 3.03Å; L408-T411 PolarHBondContact O-N 2.94Å; L408-E412 HydrophobicContact CD1-CG 4.27Å; L408-E412 PolarHBondContact O-N 3.14Å; L408-E412 VanDerWaalsContact O-N 3.07Å; L408-E475 HydrophobicContact CD2-CG 3.79Å; L408-L478 HydrophobicContact CB-CD2 4.29Å; L408-L478 HydrophobicContact CD2-CD2 4.06Å; L408-L478 HydrophobicContact CG-CD2 4.24Å; L408-I482 HydrophobicContact CG-CD1 4.33Å
409	L	98.8	Very high	98.4	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-56.7	-52.2	179.1	179.2	59.5	0	0	0	111.5	F134 M405 T411 E412 L413 L429 N431 L478 I482	F134-L409 HydrophobicContact CE1-CD2 4.45Å; M405-L409 WeakPolarHBondContact O-CB 3.37Å; M405-L409 PolarHBondContact O-N 2.9Å; L409-T411 VanDerWaalsContact C-N 3.31Å; L409-T411 PolarHBondContact O-N 3.11Å; L409-E412 PolarHBondContact O-N 3.31Å; L409-L413 HydrophobicContact CD1-CD1 3.74Å; L409-L413 HydrophobicContact CD1-CD2 4.31Å; L409-L413 HydrophobicContact CD1-CG 3.86Å; L409-L413 HydrophobicContact CD2-CD1 4.45Å; L409-L413 HydrophobicContact CG-CD1 3.73Å; L409-L413 HydrophobicContact CG-CG 4.24Å; L409-L413 WeakPolarHBondContact O-CB 3.39Å; L409-L413 WeakPolarHBondContact O-CG 3.12Å; L409-L413 PolarHBondContact O-N 3.2Å; L409-L429 HydrophobicContact CD2-CD2 4.31Å; L409-N431 HydrophobicContact CD2-CB 4.4Å; L409-L478 HydrophobicContact CB-CD1 4.33Å; L409-L478 HydrophobicContact CB-CD2 4.31Å; L409-L478 HydrophobicContact CD1-CD1 4.18Å; L409-I482 HydrophobicContact CD1-CD1 4.39Å; L409-I482 HydrophobicContact CD1-CG1 3.89Å
410	R	98.8	Very high	98.3	Very high	13 Å²	13	53 Å²	53	5%	0.049	25%	0.245	C	C	.	.	H	α-helix	trans	-63.5	-36	179.8	-72.8	-170.9	-62	-80.2	-5.1	112.7	G406 E407 L408 R414 V424 G428 N431	G406-R410 WeakPolarHBondContact O-CG 3.5Å; G406-R410 PolarHBondContact O-N 3.48Å; G406-R410 PolarHBondContact O-NH1 3.17Å; E407-R410 IonicContact OE2-CZ 3.7Å; E407-R410 IonicContact OE2-NE 3.79Å; E407-R410 IonicContact OE2-NH2 2.79Å; E407-R410 PolarHBondContact OE2-NH2 2.88Å; L408-R410 PolarHBondContact O-N 3.03Å; R410-R414 WeakPolarHBondContact O-CB 3.2Å; R410-R414 WeakPolarHBondContact O-CD 3.34Å; R410-R414 WeakPolarHBondContact O-CG 3Å; R410-R414 PolarHBondContact O-N 2.82Å; R410-V424 HydrophobicContact CB-CG1 4.44Å; R410-V424 HydrophobicContact CG-CG1 4.31Å; R410-G428 PolarHBondContact NH1-O 3.01Å; R410-N431 WeakPolarHBondContact CD-OD1 3.08Å; R410-N431 WeakPolarHBondContact CG-OD1 3.17Å; R410-N431 PolarHBondContact NH1-OD1 3.29Å
411	T	98.7	Very high	98.3	Very high	57 Å²	57	48 Å²	48	35%	0.35	22%	0.221	S	C	.	.	H	α-helix	trans	-61	-45	177.1	-64.8	0	0	0	0	111.2	E407 L408 L409	E407-T411 VanDerWaalsContact O-CB 3.29Å; E407-T411 WeakPolarHBondContact O-CB 3.31Å; E407-T411 PolarHBondContact O-N 2.89Å; E407-T411 PolarHBondContact O-OG1 3.39Å; L408-T411 PolarHBondContact O-N 2.94Å; L409-T411 VanDerWaalsContact C-N 3.31Å; L409-T411 PolarHBondContact O-N 3.11Å
412	E	98.6	Very high	98.3	Very high	30 Å²	30	49.9 Å²	49.9	14%	0.14	23%	0.234	C	C	.	.	H	α-helix	trans	-74	-39.2	179	-64.6	-52.8	127.4	0	0	112.9	L408 L409 R414 K415 I482	L408-E412 HydrophobicContact CD1-CG 4.27Å; L408-E412 PolarHBondContact O-N 3.14Å; L408-E412 VanDerWaalsContact O-N 3.07Å; L409-E412 PolarHBondContact O-N 3.31Å; E412-R414 VanDerWaalsContact C-N 3.28Å; E412-R414 PolarHBondContact O-N 3.49Å; E412-K415 WeakPolarHBondContact O-CB 3.22Å; E412-K415 PolarHBondContact O-N 2.91Å; E412-K415 VanDerWaalsContact O-N 3.11Å; E412-K415 WeakPolarHBondContact OE1-CE 3.38Å; E412-K415 IonicContact OE1-NZ 2.62Å; E412-K415 PolarHBondContact OE1-NZ 3.11Å; E412-K415 WeakPolarHBondContact OE2-CE 3.32Å; E412-K415 IonicContact OE2-NZ 2.74Å; E412-K415 PolarHBondContact OE2-NZ 2.88Å; E412-I482 HydrophobicContact CB-CD1 4.01Å; E412-I482 HydrophobicContact CB-CG1 4.31Å; E412-I482 HydrophobicContact CB-CG2 3.58Å; E412-I482 HydrophobicContact CG-CD1 3.9Å; E412-I482 HydrophobicContact CG-CG2 3.98Å
413	L	98.4	Very high	98.2	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-63.7	-32.5	177.3	-68.7	177.2	0	0	0	112.5	L409 K415 L416 V424 I433 L467 I485	L409-L413 HydrophobicContact CD1-CD1 3.74Å; L409-L413 HydrophobicContact CD1-CD2 4.31Å; L409-L413 HydrophobicContact CD1-CG 3.86Å; L409-L413 HydrophobicContact CD2-CD1 4.45Å; L409-L413 HydrophobicContact CG-CD1 3.73Å; L409-L413 HydrophobicContact CG-CG 4.24Å; L409-L413 WeakPolarHBondContact O-CB 3.39Å; L409-L413 WeakPolarHBondContact O-CG 3.12Å; L409-L413 PolarHBondContact O-N 3.2Å; L413-K415 PolarHBondContact O-N 3.32Å; L413-L416 HydrophobicContact CB-CD1 4.39Å; L413-L416 HydrophobicContact CD2-CD1 3.78Å; L413-L416 VanDerWaalsContact O-CB 3.27Å; L413-L416 WeakPolarHBondContact O-CB 3.2Å; L413-L416 WeakPolarHBondContact O-CD1 3.26Å; L413-L416 VanDerWaalsContact O-CG 3.23Å; L413-L416 WeakPolarHBondContact O-CG 3.43Å; L413-L416 PolarHBondContact O-N 3.31Å; L413-L416 VanDerWaalsContact O-N 3.12Å; L413-V424 HydrophobicContact CB-CG1 3.75Å; L413-V424 HydrophobicContact CB-CG2 4.02Å; L413-V424 HydrophobicContact CD1-CG1 4.24Å; L413-I433 HydrophobicContact CD1-CG2 3.96Å; L413-L467 HydrophobicContact CD1-CD1 3.65Å; L413-L467 HydrophobicContact CD2-CD1 4.22Å; L413-I485 HydrophobicContact CD2-CD1 4.41Å; L413-I485 HydrophobicContact CD2-CG2 3.69Å
414	R	98.4	Very high	98.2	Very high	127 Å²	127	51 Å²	51	48%	0.479	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-13.2	176.3	-75.4	167.8	-171.2	141.7	-4.4	113.7	E407 R410 E412 L416 V424	E407-R414 IonicContact OE1-NH1 3.47Å; E407-R414 PolarHBondContact OE1-NH1 2.85Å; R410-R414 WeakPolarHBondContact O-CB 3.2Å; R410-R414 WeakPolarHBondContact O-CD 3.34Å; R410-R414 WeakPolarHBondContact O-CG 3Å; R410-R414 PolarHBondContact O-N 2.82Å; E412-R414 VanDerWaalsContact C-N 3.28Å; E412-R414 PolarHBondContact O-N 3.49Å; R414-L416 VanDerWaalsContact C-N 3.35Å; R414-V424 HydrophobicContact CG-CB 4.05Å; R414-V424 HydrophobicContact CG-CG1 4.28Å; R414-V424 HydrophobicContact CG-CG2 4.33Å
415	K	98.1	Very high	98.1	Very high	126 Å²	126	48 Å²	48	55%	0.548	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-9.1	175.1	-55.8	177.9	-170.2	168.1	0	113	E412 L413	E412-K415 WeakPolarHBondContact O-CB 3.22Å; E412-K415 PolarHBondContact O-N 2.91Å; E412-K415 VanDerWaalsContact O-N 3.11Å; E412-K415 WeakPolarHBondContact OE1-CE 3.38Å; E412-K415 IonicContact OE1-NZ 2.62Å; E412-K415 PolarHBondContact OE1-NZ 3.11Å; E412-K415 WeakPolarHBondContact OE2-CE 3.32Å; E412-K415 IonicContact OE2-NZ 2.74Å; E412-K415 PolarHBondContact OE2-NZ 2.88Å; L413-K415 PolarHBondContact O-N 3.32Å
416	L	98.1	Very high	98.1	Very high	8 Å²	8	48.5 Å²	48.5	4%	0.042	24%	0.239	C	C	.	.	S	Bend	trans	-63.6	156.5	177	-64.7	173.2	0	0	0	111.3	L413 R414 K418 V421 I485 Q486 I489 M490	L413-L416 HydrophobicContact CB-CD1 4.39Å; L413-L416 HydrophobicContact CD2-CD1 3.78Å; L413-L416 VanDerWaalsContact O-CB 3.27Å; L413-L416 WeakPolarHBondContact O-CB 3.2Å; L413-L416 WeakPolarHBondContact O-CD1 3.26Å; L413-L416 VanDerWaalsContact O-CG 3.23Å; L413-L416 WeakPolarHBondContact O-CG 3.43Å; L413-L416 PolarHBondContact O-N 3.31Å; L413-L416 VanDerWaalsContact O-N 3.12Å; R414-L416 VanDerWaalsContact C-N 3.35Å; L416-K418 PolarHBondContact O-N 2.97Å; L416-V421 HydrophobicContact CB-CB 4.2Å; L416-V421 HydrophobicContact CB-CG2 4.12Å; L416-V421 HydrophobicContact CD1-CG2 4.03Å; L416-I485 HydrophobicContact CD1-CG2 4.36Å; L416-Q486 HydrophobicContact CD2-CB 4.29Å; L416-Q486 HydrophobicContact CD2-CG 3.77Å; L416-I489 HydrophobicContact CD1-CG1 4.26Å; L416-I489 HydrophobicContact CD2-CB 4.11Å; L416-I489 HydrophobicContact CD2-CG1 4.47Å; L416-I489 HydrophobicContact CD2-CG2 4.04Å; L416-M490 HydrophobicContact CD2-CE 4.13Å
417	P	97.1	Very high	98.1	Very high	33 Å²	33	51.4 Å²	51.4	21%	0.214	25%	0.252	C	S	.	.			trans	-66.4	125.5	-175.3	-16.2	33.4	0	0	0	109.5	D419 I420 V421 M490	P417-D419 WeakPolarHBondContact CB-OD1 3.3Å; P417-D419 PolarHBondContact O-N 3.14Å; P417-I420 HydrophobicContact CB-CD1 4.37Å; P417-I420 HydrophobicContact CB-CG1 4.3Å; P417-I420 HydrophobicContact CG-CD1 4.24Å; P417-I420 PolarHBondContact O-N 3.34Å; P417-V421 PolarHBondContact O-N 3.03Å; P417-M490 HydrophobicContact CG-CE 3.41Å; P417-M490 VanDerWaalsContact CG-CE 3.41Å; P417-M490 HydrophobicContact CG-SD 3.43Å; P417-M490 WeakPolarHBondContact CG-SD 3.43Å
418	K	96.9	Very high	98.1	Very high	173 Å²	173	47.6 Å²	47.6	75%	0.752	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-18.5	-175.1	-68.4	-172.1	178.3	-177.4	0	113.8	L416 I420 V421	L416-K418 PolarHBondContact O-N 2.97Å; K418-I420 VanDerWaalsContact C-N 3.31Å; K418-V421 WeakPolarHBondContact CA-O 3.38Å
419	D	96	Very high	98.1	Very high	101 Å²	101	45.8 Å²	45.8	54%	0.54	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-19	173.4	58.2	-46.4	0	0	0	113	P417 K436	P417-D419 WeakPolarHBondContact CB-OD1 3.3Å; P417-D419 PolarHBondContact O-N 3.14Å; D419-K436 WeakPolarHBondContact O-CB 3.42Å; D419-K436 WeakPolarHBondContact O-CD 3.5Å
420	I	97.6	Very high	98.1	Very high	6 Å²	6	45.9 Å²	45.9	3%	0.031	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-46.4	172.8	-51.7	179.8	0	0	0	110.7	P417 K418 I435 K436 Y441 I489 F492	P417-I420 HydrophobicContact CB-CD1 4.37Å; P417-I420 HydrophobicContact CB-CG1 4.3Å; P417-I420 HydrophobicContact CG-CD1 4.24Å; P417-I420 PolarHBondContact O-N 3.34Å; K418-I420 VanDerWaalsContact C-N 3.31Å; I420-I435 CarbonylContact O-C 3.5Å; I420-I435 WeakPolarHBondContact O-CA 3.05Å; I420-K436 PolarHBondContact O-N 2.97Å; I420-Y441 HydrophobicContact CG2-CE2 3.94Å; I420-I489 HydrophobicContact CB-CG2 4.31Å; I420-I489 HydrophobicContact CD1-CG2 4.29Å; I420-I489 WeakPolarHBondContact CD1-O 3.35Å; I420-I489 HydrophobicContact CG2-CG2 3.96Å; I420-F492 VanDerWaalsContact CD1-OXT 3.26Å; I420-F492 WeakPolarHBondContact CD1-OXT 3.03Å
421	V	98.2	Very high	98.1	Very high	6 Å²	6	45.2 Å²	45.2	4%	0.036	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	102.6	-177.9	179	0	0	0	0	109.7	L416 P417 K418 V424 I433 V434 I435 I489	L416-V421 HydrophobicContact CB-CB 4.2Å; L416-V421 HydrophobicContact CB-CG2 4.12Å; L416-V421 HydrophobicContact CD1-CG2 4.03Å; P417-V421 PolarHBondContact O-N 3.03Å; K418-V421 WeakPolarHBondContact CA-O 3.38Å; V421-V424 HydrophobicContact CG1-CG2 3.98Å; V421-I433 HydrophobicContact CG1-CB 3.9Å; V421-I433 HydrophobicContact CG1-CG2 4.2Å; V421-I433 HydrophobicContact CG2-CD1 4.44Å; V421-V434 CarbonylContact C-O 3.46Å; V421-V434 WeakPolarHBondContact CA-O 3.35Å; V421-I435 HydrophobicContact CG2-CD1 4.11Å; V421-I489 HydrophobicContact CG2-CD1 4.16Å; V421-I489 HydrophobicContact CG2-CG2 4.06Å
422	T	97.6	Very high	98.1	Very high	69 Å²	69	42.5 Å²	42.5	42%	0.423	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	-30.6	-173.3	63	0	0	0	0	112.7	V434 K436	T422-V434 PolarHBondContact N-O 2.79Å; T422-V434 WeakPolarHBondContact OG1-CB 3.4Å; T422-V434 WeakPolarHBondContact OG1-CG1 3.44Å; T422-K436 HydrophobicContact CG2-CB 3.74Å; T422-K436 HydrophobicContact CG2-CG 4.23Å
423	T	97.8	Very high	98.1	Very high	58 Å²	58	41.2 Å²	41.2	36%	0.356	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	140	-174.2	-57.4	0	0	0	0	110.9	R425 I433 V434	T423-R425 HydrophobicContact CG2-CB 4.44Å; T423-R425 HydrophobicContact CG2-CG 4.42Å; T423-I433 CarbonylContact O-C 3.56Å; T423-I433 VanDerWaalsContact O-CA 3.3Å; T423-I433 WeakPolarHBondContact O-CA 3.49Å; T423-V434 HydrophobicContact CG2-CG2 4.48Å; T423-V434 PolarHBondContact O-N 3.42Å
424	V	98.4	Very high	98.1	Very high	27 Å²	27	41.8 Å²	41.8	16%	0.164	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	123.2	167.9	-179.1	0	0	0	0	107.8	R410 L413 R414 V421 I433	R410-V424 HydrophobicContact CB-CG1 4.44Å; R410-V424 HydrophobicContact CG-CG1 4.31Å; L413-V424 HydrophobicContact CB-CG1 3.75Å; L413-V424 HydrophobicContact CB-CG2 4.02Å; L413-V424 HydrophobicContact CD1-CG1 4.24Å; R414-V424 HydrophobicContact CG-CB 4.05Å; R414-V424 HydrophobicContact CG-CG1 4.28Å; R414-V424 HydrophobicContact CG-CG2 4.33Å; V421-V424 HydrophobicContact CG1-CG2 3.98Å; V424-I433 HydrophobicContact CG1-CG2 4.49Å; V424-I433 HydrophobicContact CG2-CG2 4.07Å
425	R	98.1	Very high	98.1	Very high	52 Å²	52	35.8 Å²	35.8	20%	0.196	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	160.5	-177.4	62.7	-178.6	177.9	-97.4	-3.7	112.3	G290 V291 T423 N431 A432	G290-R425 PolarHBondContact O-NE 3.43Å; G290-R425 PolarHBondContact O-NH2 2.76Å; V291-R425 WeakPolarHBondContact O-CD 3.27Å; V291-R425 WeakPolarHBondContact O-CG 3.23Å; V291-R425 PolarHBondContact O-NE 3.26Å; T423-R425 HydrophobicContact CG2-CB 4.44Å; T423-R425 HydrophobicContact CG2-CG 4.42Å; R425-N431 CarbonylContact O-C 3.42Å; R425-N431 VanDerWaalsContact O-CA 3.3Å; R425-N431 WeakPolarHBondContact O-CA 3.42Å; R425-A432 PolarHBondContact N-O 3.31Å; R425-A432 PolarHBondContact O-N 3.08Å
426	G	98.5	Very high	98.1	Very high	12 Å²	12	35.1 Å²	35.1	12%	0.124	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	148.7	172.8	178	0	0	0	0	0	113.8	L430	G426-L430 CarbonylContact C-O 3.4Å; G426-L430 WeakPolarHBondContact CA-O 3.33Å
427	K	98.8	Very high	97.9	Very high	62 Å²	62	39.7 Å²	39.7	27%	0.27	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	144.9	167.6	-73.1	-165.5	178.2	-176.8	0	109	I285 V293 T325 L429 L430	I285-K427 HydrophobicContact CD1-CB 3.85Å; I285-K427 HydrophobicContact CD1-CD 4.19Å; I285-K427 HydrophobicContact CD1-CG 4.05Å; V293-K427 HydrophobicContact CG1-CG 4.28Å; T325-K427 HydrophobicContact CG2-CB 4.38Å; K427-L429 PolarHBondContact O-N 2.71Å; K427-L430 PolarHBondContact N-O 3.46Å; K427-L430 VanDerWaalsContact N-O 3.14Å; K427-L430 PolarHBondContact O-N 2.9Å
428	G	98.8	Very high	97.8	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	-134.7	-171.8	0	0	0	0	0	111.6	T325 A402 G406 R410 L430 N431	T325-G428 WeakPolarHBondContact O-CA 3.32Å; T325-G428 PolarHBondContact O-N 3.18Å; A402-G428 CarbonylContact O-C 3.23Å; A402-G428 VanDerWaalsContact O-C 3.31Å; A402-G428 VanDerWaalsContact O-CA 3.22Å; A402-G428 WeakPolarHBondContact O-CA 3.12Å; G406-G428 WeakPolarHBondContact CA-O 3.28Å; R410-G428 PolarHBondContact NH1-O 3.01Å; G428-L430 VanDerWaalsContact C-N 3.35Å; G428-N431 PolarHBondContact O-ND2 3.01Å
429	L	98.9	Very high	97.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	27.1	175.2	-74.6	172.9	0	0	0	112.7	R324 A402 M405 L409 K427 A468 P469 L471 I473	R324-L429 PolarHBondContact NH1-O 2.94Å; R324-L429 PolarHBondContact O-N 3.41Å; A402-L429 HydrophobicContact CB-CD1 4.43Å; A402-L429 HydrophobicContact CB-CG 4.43Å; M405-L429 HydrophobicContact CB-CD1 3.96Å; M405-L429 HydrophobicContact CB-CD2 3.93Å; M405-L429 HydrophobicContact CB-CG 4.12Å; L409-L429 HydrophobicContact CD2-CD2 4.31Å; K427-L429 PolarHBondContact O-N 2.71Å; L429-A468 VanDerWaalsContact O-CA 3.28Å; L429-A468 WeakPolarHBondContact O-CA 3.22Å; L429-A468 WeakPolarHBondContact O-CB 3.42Å; L429-P469 HydrophobicContact CD1-CG 4.38Å; L429-P469 HydrophobicContact CD2-CG 4Å; L429-L471 HydrophobicContact CB-CD2 3.74Å; L429-L471 HydrophobicContact CD1-CD2 3.81Å; L429-L471 HydrophobicContact CG-CD2 4.37Å; L429-I473 HydrophobicContact CD1-CG2 3.79Å
430	L	98.9	Very high	97.4	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	95.3	162.5	-177.5	62.8	0	0	0	108.1	I285 V291 T320 R324 T325 G426 K427 G428 A468	I285-L430 HydrophobicContact CG2-CD2 4.25Å; V291-L430 HydrophobicContact CG1-CD2 4.35Å; V291-L430 HydrophobicContact CG1-CG 3.84Å; V291-L430 HydrophobicContact CG2-CD1 4Å; V291-L430 HydrophobicContact CG2-CG 4.12Å; T320-L430 HydrophobicContact CG2-CD2 4.14Å; R324-L430 HydrophobicContact CG-CB 3.85Å; T325-L430 HydrophobicContact CG2-CD2 4.47Å; G426-L430 CarbonylContact C-O 3.4Å; G426-L430 WeakPolarHBondContact CA-O 3.33Å; K427-L430 PolarHBondContact N-O 3.46Å; K427-L430 VanDerWaalsContact N-O 3.14Å; K427-L430 PolarHBondContact O-N 2.9Å; G428-L430 VanDerWaalsContact C-N 3.35Å; L430-A468 HydrophobicContact CD1-CB 4.4Å
431	N	98.8	Very high	97.4	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	157.5	-176.2	-57.7	-77.4	0	0	0	111.5	L409 R410 R425 G428 L467	L409-N431 HydrophobicContact CD2-CB 4.4Å; R410-N431 WeakPolarHBondContact CD-OD1 3.08Å; R410-N431 WeakPolarHBondContact CG-OD1 3.17Å; R410-N431 PolarHBondContact NH1-OD1 3.29Å; R425-N431 CarbonylContact O-C 3.42Å; R425-N431 VanDerWaalsContact O-CA 3.3Å; R425-N431 WeakPolarHBondContact O-CA 3.42Å; G428-N431 PolarHBondContact O-ND2 3.01Å; N431-L467 PolarHBondContact N-O 3.07Å; N431-L467 PolarHBondContact O-N 2.89Å
432	A	98.6	Very high	97.3	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	153.6	171.8	0	0	0	0	0	111.3	V291 R425 I464 I465	V291-A432 HydrophobicContact CB-CB 3.83Å; V291-A432 HydrophobicContact CG2-CB 3.83Å; R425-A432 PolarHBondContact N-O 3.31Å; R425-A432 PolarHBondContact O-N 3.08Å; A432-I464 HydrophobicContact CB-CG2 3.79Å; A432-I465 WeakPolarHBondContact CA-O 3.47Å
433	I	98.6	Very high	97.3	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	146.8	167	62.3	175.9	0	0	0	109.5	L413 V421 T423 V424 I435 I464 I465 L467 I489	L413-I433 HydrophobicContact CD1-CG2 3.96Å; V421-I433 HydrophobicContact CG1-CB 3.9Å; V421-I433 HydrophobicContact CG1-CG2 4.2Å; V421-I433 HydrophobicContact CG2-CD1 4.44Å; T423-I433 CarbonylContact O-C 3.56Å; T423-I433 VanDerWaalsContact O-CA 3.3Å; T423-I433 WeakPolarHBondContact O-CA 3.49Å; V424-I433 HydrophobicContact CG1-CG2 4.49Å; V424-I433 HydrophobicContact CG2-CG2 4.07Å; I433-I435 HydrophobicContact CD1-CD1 3.95Å; I433-I435 HydrophobicContact CG1-CD1 4.26Å; I433-I464 WeakPolarHBondContact O-CA 3.12Å; I433-I465 HydrophobicContact CD1-CB 4.45Å; I433-I465 HydrophobicContact CG1-CB 3.88Å; I433-I465 PolarHBondContact N-O 3.2Å; I433-I465 PolarHBondContact O-N 3.49Å; I433-L467 HydrophobicContact CD1-CD1 4.36Å; I433-L467 HydrophobicContact CG1-CD1 4.36Å; I433-L467 HydrophobicContact CG2-CD1 4.08Å; I433-I489 HydrophobicContact CD1-CD1 4.3Å
434	V	98.3	Very high	97.3	Very high	13 Å²	13	43.5 Å²	43.5	8%	0.079	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	124.4	173.7	-178.3	0	0	0	0	108.9	V421 T422 T423 D463 I464	V421-V434 CarbonylContact C-O 3.46Å; V421-V434 WeakPolarHBondContact CA-O 3.35Å; T422-V434 PolarHBondContact N-O 2.79Å; T422-V434 WeakPolarHBondContact OG1-CB 3.4Å; T422-V434 WeakPolarHBondContact OG1-CG1 3.44Å; T423-V434 HydrophobicContact CG2-CG2 4.48Å; T423-V434 PolarHBondContact O-N 3.42Å; V434-D463 VanDerWaalsContact CG1-OD2 3.32Å; V434-D463 WeakPolarHBondContact CG1-OD2 3.42Å; V434-I464 HydrophobicContact CG2-CG1 4.37Å
435	I	98.2	Very high	97.3	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	131.2	179.3	-57	-55	0	0	0	109.2	I420 V421 I433 E437 Y441 A443 V446 D463 I465 I489	I420-I435 CarbonylContact O-C 3.5Å; I420-I435 WeakPolarHBondContact O-CA 3.05Å; V421-I435 HydrophobicContact CG2-CD1 4.11Å; I433-I435 HydrophobicContact CD1-CD1 3.95Å; I433-I435 HydrophobicContact CG1-CD1 4.26Å; I435-E437 PolarHBondContact O-N 3.39Å; I435-E437 VanDerWaalsContact O-N 3.17Å; I435-Y441 HydrophobicContact CG2-CD2 4.09Å; I435-Y441 HydrophobicContact CG2-CE2 3.9Å; I435-A443 HydrophobicContact CB-CB 4.2Å; I435-A443 HydrophobicContact CG1-CB 3.98Å; I435-V446 HydrophobicContact CG2-CG2 4.45Å; I435-D463 PolarHBondContact N-O 2.85Å; I435-I465 HydrophobicContact CD1-CD1 3.99Å; I435-I465 HydrophobicContact CG1-CD1 3.67Å; I435-I465 HydrophobicContact CG1-CG1 4.06Å; I435-I489 HydrophobicContact CD1-CD1 4.05Å
436	K	97.2	Very high	97.3	Very high	113 Å²	113	43.7 Å²	43.7	49%	0.491	21%	0.208	S	C	.	.			trans	-76.6	100.5	168.7	-166.7	-174.7	-177.3	-177.4	0	108.7	D419 I420 T422 Y441	D419-K436 WeakPolarHBondContact O-CB 3.42Å; D419-K436 WeakPolarHBondContact O-CD 3.5Å; I420-K436 PolarHBondContact O-N 2.97Å; T422-K436 HydrophobicContact CG2-CB 3.74Å; T422-K436 HydrophobicContact CG2-CG 4.23Å; K436-Y441 WeakPolarHBondContact O-CE2 3.29Å
437	E	94.6	Very high	97.3	Very high	103 Å²	103	43.1 Å²	43.1	48%	0.481	20%	0.202	S	C	.	.			trans	-64.4	140.8	-179.5	-59.8	-168.8	151.6	0	0	112	I435 D442 D463	I435-E437 PolarHBondContact O-N 3.39Å; I435-E437 VanDerWaalsContact O-N 3.17Å; E437-D442 HydrophobicContact CG-CB 4.24Å; E437-D463 HydrophobicContact CG-CB 3.94Å
438	T	95.1	Very high	97.3	Very high	57 Å²	57	42.2 Å²	42.2	35%	0.35	20%	0.2	S	C	.	.			trans	-130.7	179.9	175.7	72.9	0	0	0	0	109.6	D440 Y441	T438-D440 PolarHBondContact O-N 3.12Å; T438-D440 PolarHBondContact OG1-N 2.87Å; T438-D440 VanDerWaalsContact OG1-N 3.16Å; T438-Y441 HydrophobicContact CG2-CE1 3.92Å; T438-Y441 HydrophobicContact CG2-CE2 4.4Å; T438-Y441 PolarHBondContact N-O 3.31Å; T438-Y441 VanDerWaalsContact O-O 3.12Å; T438-Y441 WeakPolarHBondContact OG1-CD1 3.48Å; T438-Y441 WeakPolarHBondContact OG1-CE1 3.39Å; T438-Y441 PolarHBondContact OG1-N 2.88Å; T438-Y441 VanDerWaalsContact OG1-N 3.16Å
439	K	92.4	Very high	97.3	Very high	205 Å²	205	47.8 Å²	47.8	89%	0.891	22%	0.221	S	C	*	.	S	Bend	trans	-66.4	-28	171.7	-66.7	-176.2	179.2	179.5	0	112.2
440	D	93.1	Very high	97.3	Very high	133 Å²	133	48 Å²	48	71%	0.711	22%	0.221	S	C	*	.	S	Bend	trans	-87.8	-33.9	-172.3	-59.2	-43.4	0	0	0	111.5	T438 K445	T438-D440 PolarHBondContact O-N 3.12Å; T438-D440 PolarHBondContact OG1-N 2.87Å; T438-D440 VanDerWaalsContact OG1-N 3.16Å; D440-K445 PolarHBondContact O-NZ 3.27Å
441	Y	96	Very high	97.3	Very high	19 Å²	19	50.2 Å²	50.2	8%	0.075	23%	0.23	C	C	.	.			trans	-147.8	155	179.9	67.8	-94	0	0	0	114.7	I420 I435 K436 T438 F492	I420-Y441 HydrophobicContact CG2-CE2 3.94Å; I435-Y441 HydrophobicContact CG2-CD2 4.09Å; I435-Y441 HydrophobicContact CG2-CE2 3.9Å; K436-Y441 WeakPolarHBondContact O-CE2 3.29Å; T438-Y441 HydrophobicContact CG2-CE1 3.92Å; T438-Y441 HydrophobicContact CG2-CE2 4.4Å; T438-Y441 PolarHBondContact N-O 3.31Å; T438-Y441 VanDerWaalsContact O-O 3.12Å; T438-Y441 WeakPolarHBondContact OG1-CD1 3.48Å; T438-Y441 WeakPolarHBondContact OG1-CE1 3.39Å; T438-Y441 PolarHBondContact OG1-N 2.88Å; T438-Y441 VanDerWaalsContact OG1-N 3.16Å; Y441-F492 HydrophobicContact CD1-CB 3.78Å; Y441-F492 AromaticContact CD1-CD1 3.94Å; Y441-F492 HydrophobicContact CD1-CD1 3.94Å; Y441-F492 HydrophobicContact CD1-CG 4.23Å; Y441-F492 HydrophobicContact CD2-CB 4.46Å; Y441-F492 HydrophobicContact CD2-CD1 4.46Å; Y441-F492 HydrophobicContact CE1-CB 3.92Å; Y441-F492 HydrophobicContact CG-CB 4.05Å; Y441-F492 AromaticContact CG-CD1 3.69Å; Y441-F492 HydrophobicContact CG-CD1 3.69Å; Y441-F492 HydrophobicContact CG-CE1 4.43Å; Y441-F492 HydrophobicContact CG-CG 4.07Å
442	D	97.4	Very high	97.3	Very high	49 Å²	49	54.9 Å²	54.9	26%	0.262	26%	0.255	S	S	.	.			trans	-136.5	176.2	174.9	56.8	28.6	0	0	0	109.4	E437 W444 K445 V446	E437-D442 HydrophobicContact CG-CB 4.24Å; D442-W444 PolarHBondContact O-N 2.94Å; D442-W444 WeakPolarHBondContact OD1-CB 3.25Å; D442-W444 PolarHBondContact OD1-N 3.17Å; D442-W444 VanDerWaalsContact OD1-N 3.14Å; D442-K445 PolarHBondContact O-N 3.02Å; D442-K445 WeakPolarHBondContact OD1-CB 3.29Å; D442-K445 WeakPolarHBondContact OD1-CG 3.48Å; D442-K445 PolarHBondContact OD1-N 3.36Å; D442-V446 WeakPolarHBondContact O-CG2 3.48Å; D442-V446 PolarHBondContact O-N 2.87Å; D442-V446 VanDerWaalsContact O-N 3.15Å
443	A	97.6	Very high	97.3	Very high	0 Å²	0	58 Å²	58	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-62.6	-27.5	179.6	0	0	0	0	0	113.4	I435 C447 P459 G462 I465	I435-A443 HydrophobicContact CB-CB 4.2Å; I435-A443 HydrophobicContact CG1-CB 3.98Å; A443-C447 PolarHBondContact O-N 3.45Å; A443-C447 PolarHBondContact O-SG 2.93Å; A443-P459 HydrophobicContact CB-CB 4.04Å; A443-P459 HydrophobicContact CB-CG 4.05Å; A443-G462 VanDerWaalsContact CB-O 3.32Å; A443-G462 WeakPolarHBondContact CB-O 3.37Å; A443-I465 HydrophobicContact CB-CD1 4.13Å; A443-I465 HydrophobicContact CB-CG1 3.81Å
444	W	97.8	Very high	97.3	Very high	63 Å²	63	58.7 Å²	58.7	24%	0.239	28%	0.279	C	S	.	.	H	α-helix	trans	-67.7	-48.4	177	179.7	-105	0	0	0	111.7	H109 L111 D442 V446 C447 L448 P459	H109-W444 AromaticContact CE1-CH2 3.92Å; H109-W444 AromaticContact CE1-CZ2 3.85Å; H109-W444 AromaticContact NE2-CZ2 3.99Å; L111-W444 HydrophobicContact CD1-CE3 4.43Å; L111-W444 HydrophobicContact CD1-CH2 3.96Å; L111-W444 HydrophobicContact CD1-CZ2 4.3Å; L111-W444 HydrophobicContact CD1-CZ3 4.01Å; D442-W444 PolarHBondContact O-N 2.94Å; D442-W444 WeakPolarHBondContact OD1-CB 3.25Å; D442-W444 PolarHBondContact OD1-N 3.17Å; D442-W444 VanDerWaalsContact OD1-N 3.14Å; W444-V446 VanDerWaalsContact C-N 3.28Å; W444-V446 PolarHBondContact O-N 3.19Å; W444-C447 PolarHBondContact O-N 2.78Å; W444-C447 VanDerWaalsContact O-N 3.07Å; W444-L448 HydrophobicContact CZ2-CD2 4.48Å; W444-L448 WeakPolarHBondContact O-CG 3.5Å; W444-L448 PolarHBondContact O-N 3.01Å; W444-P459 HydrophobicContact CE3-CG 4.29Å
445	K	97.9	Very high	97.3	Very high	84 Å²	84	58 Å²	58	37%	0.365	28%	0.275	S	S	.	.	H	α-helix	trans	-59.5	-38.9	174.3	-76.5	168.7	171.6	177.2	0	111.9	D440 D442 L448 R449 F492	D440-K445 PolarHBondContact O-NZ 3.27Å; D442-K445 PolarHBondContact O-N 3.02Å; D442-K445 WeakPolarHBondContact OD1-CB 3.29Å; D442-K445 WeakPolarHBondContact OD1-CG 3.48Å; D442-K445 PolarHBondContact OD1-N 3.36Å; K445-L448 PolarHBondContact O-N 3.38Å; K445-R449 PolarHBondContact O-N 2.79Å; K445-F492 HydrophobicContact CB-CE1 4.36Å
446	V	98.4	Very high	97.3	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-61	-45.7	172.8	174.9	0	0	0	0	110.7	I435 D442 W444 L448 R449 L450 I465 T488 I489 F492	I435-V446 HydrophobicContact CG2-CG2 4.45Å; D442-V446 WeakPolarHBondContact O-CG2 3.48Å; D442-V446 PolarHBondContact O-N 2.87Å; D442-V446 VanDerWaalsContact O-N 3.15Å; W444-V446 VanDerWaalsContact C-N 3.28Å; W444-V446 PolarHBondContact O-N 3.19Å; V446-L448 PolarHBondContact O-N 3.07Å; V446-R449 PolarHBondContact O-N 3.22Å; V446-L450 HydrophobicContact CG1-CD1 4.21Å; V446-L450 HydrophobicContact CG1-CG 4.44Å; V446-L450 WeakPolarHBondContact O-CG 3.22Å; V446-L450 PolarHBondContact O-N 3.25Å; V446-I465 HydrophobicContact CB-CD1 3.77Å; V446-I465 HydrophobicContact CG1-CD1 3.46Å; V446-I465 VanDerWaalsContact CG1-CD1 3.46Å; V446-T488 HydrophobicContact CG1-CG2 4.45Å; V446-I489 HydrophobicContact CG1-CD1 3.73Å; V446-F492 HydrophobicContact CB-CE2 4.28Å; V446-F492 HydrophobicContact CG2-CD2 4.05Å; V446-F492 HydrophobicContact CG2-CE2 3.74Å; V446-F492 HydrophobicContact CG2-CZ 4.09Å
447	C	98.6	Very high	97.4	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-65.8	-36.9	178	-69.2	0	0	0	0	113.5	L111 A443 W444 R449 L450 R451 P459	L111-C447 HydrophobicContact CD1-CB 4.19Å; A443-C447 PolarHBondContact O-N 3.45Å; A443-C447 PolarHBondContact O-SG 2.93Å; W444-C447 PolarHBondContact O-N 2.78Å; W444-C447 VanDerWaalsContact O-N 3.07Å; C447-R449 VanDerWaalsContact C-N 3.33Å; C447-L450 PolarHBondContact O-N 3Å; C447-R451 PolarHBondContact O-N 3.42Å; C447-P459 HydrophobicContact CB-CG 4.34Å; C447-P459 WeakPolarHBondContact SG-CD 3.49Å
448	L	98.6	Very high	97.4	Very high	42 Å²	42	50.7 Å²	50.7	22%	0.22	24%	0.242	C	C	.	.	H	α-helix	trans	-60.9	-43.1	171.8	-69.5	175.5	0	0	0	111.2	L111 P112 W444 K445 V446 R451 D452	L111-L448 HydrophobicContact CD1-CD2 3.78Å; L111-L448 HydrophobicContact CD1-CG 4.38Å; P112-L448 HydrophobicContact CG-CD2 3.86Å; W444-L448 HydrophobicContact CZ2-CD2 4.48Å; W444-L448 WeakPolarHBondContact O-CG 3.5Å; W444-L448 PolarHBondContact O-N 3.01Å; K445-L448 PolarHBondContact O-N 3.38Å; V446-L448 PolarHBondContact O-N 3.07Å; L448-R451 WeakPolarHBondContact O-CB 3.46Å; L448-R451 PolarHBondContact O-N 3.49Å; L448-D452 PolarHBondContact O-N 2.92Å
449	R	98.6	Very high	97.4	Very high	118 Å²	118	48.6 Å²	48.6	45%	0.445	23%	0.23	S	C	.	.	H	α-helix	trans	-68.7	-36.9	177	-173.8	62.1	66.1	129.7	10.3	112.6	K445 V446 C447 R451 D452 N453 T488 F492	K445-R449 PolarHBondContact O-N 2.79Å; V446-R449 PolarHBondContact O-N 3.22Å; C447-R449 VanDerWaalsContact C-N 3.33Å; R449-R451 VanDerWaalsContact C-N 3.33Å; R449-D452 PolarHBondContact O-N 2.89Å; R449-N453 WeakPolarHBondContact O-CB 3.43Å; R449-N453 PolarHBondContact O-N 3.39Å; R449-N453 PolarHBondContact O-ND2 3.47Å; R449-T488 HydrophobicContact CB-CG2 3.75Å; R449-T488 HydrophobicContact CG-CG2 3.55Å; R449-F492 HydrophobicContact CB-CE2 4.18Å; R449-F492 HydrophobicContact CB-CZ 4.03Å; R449-F492 HydrophobicContact CG-CE2 4.39Å
450	L	98.8	Very high	97.3	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.016	19%	0.191	C	C	.	.	H	α-helix	trans	-59.8	-45.7	173.2	-74.4	170.5	0	0	0	110.4	V446 C447 D452 N453 G454 L455 A457 I484 I485 T488	V446-L450 HydrophobicContact CG1-CD1 4.21Å; V446-L450 HydrophobicContact CG1-CG 4.44Å; V446-L450 WeakPolarHBondContact O-CG 3.22Å; V446-L450 PolarHBondContact O-N 3.25Å; C447-L450 PolarHBondContact O-N 3Å; L450-D452 PolarHBondContact O-N 3.06Å; L450-N453 CarbonylContact O-C 3.55Å; L450-N453 WeakPolarHBondContact O-CA 3.22Å; L450-N453 PolarHBondContact O-N 2.82Å; L450-N453 VanDerWaalsContact O-N 3.11Å; L450-G454 PolarHBondContact O-N 3.11Å; L450-G454 VanDerWaalsContact O-N 3.11Å; L450-L455 CarbonylContact C-O 3.25Å; L450-L455 HydrophobicContact CB-CD2 4.28Å; L450-L455 WeakPolarHBondContact CB-O 3.39Å; L450-L455 HydrophobicContact CD1-CD2 4.27Å; L450-L455 HydrophobicContact CD2-CD2 4.3Å; L450-L455 PolarHBondContact O-N 3.47Å; L450-L455 VanDerWaalsContact O-O 3.06Å; L450-A457 HydrophobicContact CD1-CB 4.21Å; L450-I484 HydrophobicContact CD2-CG2 4.36Å; L450-I485 HydrophobicContact CD2-CB 4.49Å; L450-I485 HydrophobicContact CD2-CG1 4.06Å; L450-T488 HydrophobicContact CD2-CG2 3.74Å; L450-T488 HydrophobicContact CG-CG2 3.8Å
451	R	98.6	Very high	97	Very high	50 Å²	50	38.4 Å²	38.4	19%	0.189	18%	0.182	C	C	.	.	H	α-helix	trans	-55.9	-51.6	174.5	173.5	-154.9	67.5	178.4	-4.2	110.3	L111 P112 Y131 C447 L448 R449 N453 G454 L455 L456	L111-R451 HydrophobicContact CD2-CB 4.06Å; P112-R451 PolarHBondContact O-NH1 2.91Å; Y131-R451 HydrophobicContact CE1-CG 3.89Å; Y131-R451 VanDerWaalsContact CE1-O 3.22Å; Y131-R451 WeakPolarHBondContact CE1-O 3.5Å; C447-R451 PolarHBondContact O-N 3.42Å; L448-R451 WeakPolarHBondContact O-CB 3.46Å; L448-R451 PolarHBondContact O-N 3.49Å; R449-R451 VanDerWaalsContact C-N 3.33Å; R451-N453 PolarHBondContact O-N 3.34Å; R451-N453 VanDerWaalsContact O-N 3.14Å; R451-G454 PolarHBondContact O-N 3.02Å; R451-L455 WeakPolarHBondContact CA-O 3.44Å; R451-L455 PolarHBondContact N-O 2.89Å; R451-L456 HydrophobicContact CB-CD2 3.84Å; R451-L456 HydrophobicContact CG-CD2 3.65Å
452	D	98.6	Very high	96.6	Very high	97 Å²	97	39.8 Å²	39.8	52%	0.519	20%	0.201	S	C	.	.	H	α-helix	trans	-59.9	-27.7	-178.9	-61.9	-13.7	0	0	0	112.4	L448 R449 L450	L448-D452 PolarHBondContact O-N 2.92Å; R449-D452 PolarHBondContact O-N 2.89Å; L450-D452 PolarHBondContact O-N 3.06Å
453	N	98.7	Very high	96.5	Very high	66 Å²	66	40 Å²	40	35%	0.353	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	4.9	175.7	-68.8	-27.3	0	0	0	114.3	R449 L450 R451 I484 T488	R449-N453 WeakPolarHBondContact O-CB 3.43Å; R449-N453 PolarHBondContact O-N 3.39Å; R449-N453 PolarHBondContact O-ND2 3.47Å; L450-N453 CarbonylContact O-C 3.55Å; L450-N453 WeakPolarHBondContact O-CA 3.22Å; L450-N453 PolarHBondContact O-N 2.82Å; L450-N453 VanDerWaalsContact O-N 3.11Å; R451-N453 PolarHBondContact O-N 3.34Å; R451-N453 VanDerWaalsContact O-N 3.14Å; N453-I484 HydrophobicContact CB-CG2 3.86Å; N453-T488 PolarHBondContact ND2-OG1 3.23Å
454	G	98.6	Very high	96.5	Very high	16 Å²	16	40.7 Å²	40.7	17%	0.165	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.2	21.5	174.1	0	0	0	0	0	116.1	Y131 Y132 L450 R451	Y131-G454 CarbonylContact C-O 3.57Å; Y131-G454 VanDerWaalsContact CA-O 3.25Å; Y131-G454 WeakPolarHBondContact CA-O 2.72Å; Y132-G454 PolarHBondContact N-O 2.95Å; L450-G454 PolarHBondContact O-N 3.11Å; L450-G454 VanDerWaalsContact O-N 3.11Å; R451-G454 PolarHBondContact O-N 3.02Å
455	L	98.8	Very high	96.5	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	127	177.8	-174.5	153.7	0	0	0	111.5	F134 L450 R451 A457 C481 I484 I485	F134-L455 HydrophobicContact CB-CD2 3.77Å; F134-L455 HydrophobicContact CB-CG 4.23Å; F134-L455 HydrophobicContact CD1-CD1 4.26Å; F134-L455 HydrophobicContact CD1-CD2 4.43Å; F134-L455 HydrophobicContact CD2-CD1 3.77Å; F134-L455 HydrophobicContact CD2-CD2 4.3Å; F134-L455 HydrophobicContact CD2-CG 3.88Å; F134-L455 HydrophobicContact CE1-CD1 4.35Å; F134-L455 HydrophobicContact CE2-CD1 3.9Å; F134-L455 HydrophobicContact CE2-CG 4.47Å; F134-L455 HydrophobicContact CG-CD1 3.98Å; F134-L455 HydrophobicContact CG-CD2 3.92Å; F134-L455 HydrophobicContact CG-CG 4.01Å; F134-L455 HydrophobicContact CZ-CD1 4.18Å; L450-L455 CarbonylContact C-O 3.25Å; L450-L455 HydrophobicContact CB-CD2 4.28Å; L450-L455 WeakPolarHBondContact CB-O 3.39Å; L450-L455 HydrophobicContact CD1-CD2 4.27Å; L450-L455 HydrophobicContact CD2-CD2 4.3Å; L450-L455 PolarHBondContact O-N 3.47Å; L450-L455 VanDerWaalsContact O-O 3.06Å; R451-L455 WeakPolarHBondContact CA-O 3.44Å; R451-L455 PolarHBondContact N-O 2.89Å; L455-A457 HydrophobicContact CD2-CB 4.1Å; L455-C481 HydrophobicContact CD1-CB 3.95Å; L455-I484 HydrophobicContact CB-CG2 3.87Å; L455-I484 HydrophobicContact CD1-CG2 4.38Å; L455-I485 HydrophobicContact CD1-CD1 4.08Å; L455-I485 HydrophobicContact CD1-CG1 3.93Å
456	L	98.9	Very high	96.5	Very high	13 Å²	13	34.3 Å²	34.3	7%	0.068	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	118.4	179.4	-57.6	-177	0	0	0	111.4	L111 V113 L115 V123 Y131 Y132 F134 R451	L111-L456 HydrophobicContact CD2-CD2 4.2Å; V113-L456 HydrophobicContact CG1-CD1 4.05Å; V113-L456 HydrophobicContact CG1-CD2 4.05Å; V113-L456 HydrophobicContact CG2-CD1 4.41Å; V113-L456 HydrophobicContact CG2-CD2 4.48Å; L115-L456 HydrophobicContact CD1-CD1 4.11Å; L115-L456 HydrophobicContact CD2-CD1 3.93Å; L115-L456 HydrophobicContact CG-CD1 4.5Å; V123-L456 HydrophobicContact CG2-CD1 3.69Å; Y131-L456 HydrophobicContact CD1-CD2 3.67Å; Y131-L456 HydrophobicContact CD1-CG 4.03Å; Y131-L456 HydrophobicContact CD2-CD1 4.28Å; Y131-L456 HydrophobicContact CE1-CD2 4.15Å; Y131-L456 HydrophobicContact CG-CD1 4.05Å; Y131-L456 HydrophobicContact CG-CD2 3.94Å; Y131-L456 HydrophobicContact CG-CG 3.82Å; Y132-L456 PolarHBondContact O-N 3.4Å; F134-L456 CarbonylContact C-O 2.95Å; F134-L456 VanDerWaalsContact CA-O 3.31Å; F134-L456 WeakPolarHBondContact CA-O 2.88Å; F134-L456 VanDerWaalsContact CB-O 3.26Å; F134-L456 WeakPolarHBondContact CB-O 3.49Å; F134-L456 PolarHBondContact N-O 2.99Å; R451-L456 HydrophobicContact CB-CD2 3.84Å; R451-L456 HydrophobicContact CG-CD2 3.65Å
457	A	98	Very high	96.5	Very high	2 Å²	2	34.3 Å²	34.3	2%	0.017	18%	0.18	C	C	.	.			trans	-136.3	162.7	169.9	0	0	0	0	0	109.1	F134 L450 L455 I465 L467	F134-A457 HydrophobicContact CB-CB 4.42Å; L450-A457 HydrophobicContact CD1-CB 4.21Å; L455-A457 HydrophobicContact CD2-CB 4.1Å; A457-I465 HydrophobicContact CB-CG2 3.82Å; A457-L467 HydrophobicContact CB-CD2 4.11Å
458	K	95.3	Very high	96.5	Very high	48 Å²	48	34.5 Å²	34.5	21%	0.209	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	139.5	179.2	-165.7	179.4	-177.3	-64.1	0	111.3	H109 L135 R466	H109-K458 VanDerWaalsContact O-CE 3.29Å; H109-K458 WeakPolarHBondContact O-CE 3.48Å; L135-K458 HydrophobicContact CD1-CB 4.25Å; L135-K458 HydrophobicContact CD2-CB 4.3Å; K458-R466 PolarHBondContact O-N 3Å
459	P	95.1	Very high	96.6	Very high	12 Å²	12	32.5 Å²	32.5	8%	0.078	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	156.6	171.6	-16.4	31.6	0	0	0	112.5	A443 W444 C447 G462 I464	A443-P459 HydrophobicContact CB-CB 4.04Å; A443-P459 HydrophobicContact CB-CG 4.05Å; W444-P459 HydrophobicContact CE3-CG 4.29Å; C447-P459 HydrophobicContact CB-CG 4.34Å; C447-P459 WeakPolarHBondContact SG-CD 3.49Å; P459-G462 WeakPolarHBondContact CB-O 3.21Å; P459-I464 CarbonylContact C-O 3.41Å; P459-I464 WeakPolarHBondContact CA-O 3.3Å
460	T	91.1	Very high	96.6	Very high	13 Å²	13	26.9 Å²	26.9	8%	0.08	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	145.8	165.6	-168.2	0	0	0	0	108.7	E288 G462 I464 R466	E288-T460 PolarHBondContact O-OG1 2.98Å; T460-G462 PolarHBondContact O-N 3.3Å; T460-G462 VanDerWaalsContact O-N 3.12Å; T460-I464 HydrophobicContact CG2-CB 3.94Å; T460-I464 HydrophobicContact CG2-CG2 4.16Å; T460-I464 PolarHBondContact N-O 3.36Å; T460-I464 WeakPolarHBondContact O-CB 3.32Å; T460-I464 PolarHBondContact O-N 3.02Å; T460-R466 HydrophobicContact CG2-CG 4.15Å
461	H	85.3	Confident	96.6	Very high	112 Å²	112	26.8 Å²	26.8	52%	0.519	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.5	36	178.4	-64.4	75.2	0	0	0	115	E288 D463 I464	E288-H461 PolarHBondContact O-CE1 2.81Å; E288-H461 PolarHBondContact O-ND1 3.15Å; H461-D463 PolarHBondContact O-N 3.36Å; H461-I464 HydrophobicContact CB-CD1 4.38Å
462	G	88.7	Confident	96.6	Very high	47 Å²	47	26 Å²	26	49%	0.485	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.7	-87.1	-179.3	0	0	0	0	0	111.9	A443 P459 T460	A443-G462 VanDerWaalsContact CB-O 3.32Å; A443-G462 WeakPolarHBondContact CB-O 3.37Å; P459-G462 WeakPolarHBondContact CB-O 3.21Å; T460-G462 PolarHBondContact O-N 3.3Å; T460-G462 VanDerWaalsContact O-N 3.12Å
463	D	94.8	Very high	96.6	Very high	55 Å²	55	21.4 Å²	21.4	29%	0.294	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-1.7	-161	69.6	-18.7	0	0	0	115.3	V434 I435 E437 H461	V434-D463 VanDerWaalsContact CG1-OD2 3.32Å; V434-D463 WeakPolarHBondContact CG1-OD2 3.42Å; I435-D463 PolarHBondContact N-O 2.85Å; E437-D463 HydrophobicContact CG-CB 3.94Å; H461-D463 PolarHBondContact O-N 3.36Å
464	I	97.8	Very high	96.6	Very high	14 Å²	14	25.8 Å²	25.8	7%	0.072	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	121.9	-172.3	-46.2	173.4	0	0	0	110.6	A432 I433 V434 P459 T460 H461	A432-I464 HydrophobicContact CB-CG2 3.79Å; I433-I464 WeakPolarHBondContact O-CA 3.12Å; V434-I464 HydrophobicContact CG2-CG1 4.37Å; P459-I464 CarbonylContact C-O 3.41Å; P459-I464 WeakPolarHBondContact CA-O 3.3Å; T460-I464 HydrophobicContact CG2-CB 3.94Å; T460-I464 HydrophobicContact CG2-CG2 4.16Å; T460-I464 PolarHBondContact N-O 3.36Å; T460-I464 WeakPolarHBondContact O-CB 3.32Å; T460-I464 PolarHBondContact O-N 3.02Å; H461-I464 HydrophobicContact CB-CD1 4.38Å
465	I	98.3	Very high	96.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	123.2	174.4	-56.7	176.3	0	0	0	109.9	A432 I433 I435 A443 V446 A457 L467	A432-I465 WeakPolarHBondContact CA-O 3.47Å; I433-I465 HydrophobicContact CD1-CB 4.45Å; I433-I465 HydrophobicContact CG1-CB 3.88Å; I433-I465 PolarHBondContact N-O 3.2Å; I433-I465 PolarHBondContact O-N 3.49Å; I435-I465 HydrophobicContact CD1-CD1 3.99Å; I435-I465 HydrophobicContact CG1-CD1 3.67Å; I435-I465 HydrophobicContact CG1-CG1 4.06Å; A443-I465 HydrophobicContact CB-CD1 4.13Å; A443-I465 HydrophobicContact CB-CG1 3.81Å; V446-I465 HydrophobicContact CB-CD1 3.77Å; V446-I465 HydrophobicContact CG1-CD1 3.46Å; V446-I465 VanDerWaalsContact CG1-CD1 3.46Å; A457-I465 HydrophobicContact CB-CG2 3.82Å; I465-L467 HydrophobicContact CG2-CD2 4.21Å
466	R	98.1	Very high	96.6	Very high	12 Å²	12	35 Å²	35	5%	0.045	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	135.9	174.3	-69.8	-175.9	-86.8	-174	-14.4	110.9	Y138 E288 V291 K458 T460	Y138-R466 VanDerWaalsContact CE1-NH2 3.33Å; E288-R466 IonicContact OE1-CZ 3.43Å; E288-R466 IonicContact OE1-NH1 3.5Å; E288-R466 PolarHBondContact OE1-NH1 2.88Å; E288-R466 IonicContact OE1-NH2 3.55Å; E288-R466 IonicContact OE2-CZ 2.74Å; E288-R466 IonicContact OE2-NH1 3.58Å; E288-R466 PolarHBondContact OE2-NH1 3.02Å; E288-R466 VanDerWaalsContact OE2-NH1 3.11Å; E288-R466 IonicContact OE2-NH2 3.53Å; E288-R466 PolarHBondContact OE2-NH2 3.42Å; V291-R466 HydrophobicContact CG2-CG 4.3Å; K458-R466 PolarHBondContact O-N 3Å; T460-R466 HydrophobicContact CG2-CG 4.15Å
467	L	98.5	Very high	96.6	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	87.4	179.9	-62.3	174.9	0	0	0	108.7	F134 L413 N431 I433 A457 I465 I485	F134-L467 HydrophobicContact CB-CD2 4.44Å; F134-L467 HydrophobicContact CD1-CB 3.95Å; F134-L467 HydrophobicContact CD1-CD2 3.78Å; F134-L467 HydrophobicContact CD1-CG 4.44Å; L413-L467 HydrophobicContact CD1-CD1 3.65Å; L413-L467 HydrophobicContact CD2-CD1 4.22Å; N431-L467 PolarHBondContact N-O 3.07Å; N431-L467 PolarHBondContact O-N 2.89Å; I433-L467 HydrophobicContact CD1-CD1 4.36Å; I433-L467 HydrophobicContact CG1-CD1 4.36Å; I433-L467 HydrophobicContact CG2-CD1 4.08Å; A457-L467 HydrophobicContact CB-CD2 4.11Å; I465-L467 HydrophobicContact CG2-CD2 4.21Å; L467-I485 HydrophobicContact CD1-CD1 4.29Å; L467-I485 HydrophobicContact CD2-CD1 4.29Å
468	A	98.6	Very high	96.6	Very high	4 Å²	4	35.4 Å²	35.4	3%	0.033	18%	0.177	C	C	.	.			trans	-133.2	79.8	-175	0	0	0	0	0	111.4	F134 L135 S136 L429 L430	F134-A468 CarbonylContact C-O 3.5Å; F134-A468 CarbonylContact O-C 3.57Å; F134-A468 PolarHBondContact O-N 3.1Å; L135-A468 CarbonylContact C-O 3.58Å; S136-A468 WeakPolarHBondContact CB-O 3.2Å; S136-A468 PolarHBondContact N-O 3.01Å; S136-A468 PolarHBondContact OG-O 3.39Å; L429-A468 VanDerWaalsContact O-CA 3.28Å; L429-A468 WeakPolarHBondContact O-CA 3.22Å; L429-A468 WeakPolarHBondContact O-CB 3.42Å; L430-A468 HydrophobicContact CD1-CB 4.4Å
469	P	98.8	Very high	96.8	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.006	18%	0.183	C	C	.	.			trans	-75.1	167	177.9	31.8	-35.9	0	0	0	112.8	D133 F134 S136 R324 L429 I473	D133-P469 WeakPolarHBondContact O-CA 3.43Å; F134-P469 HydrophobicContact CD1-CG 4.41Å; F134-P469 HydrophobicContact CD2-CB 3.87Å; F134-P469 HydrophobicContact CE1-CB 4.46Å; F134-P469 HydrophobicContact CE1-CG 4.1Å; F134-P469 HydrophobicContact CE2-CB 3.75Å; F134-P469 HydrophobicContact CE2-CG 4.17Å; F134-P469 HydrophobicContact CG-CB 4.25Å; F134-P469 HydrophobicContact CZ-CB 4.07Å; F134-P469 HydrophobicContact CZ-CG 3.96Å; S136-P469 WeakPolarHBondContact OG-CA 3.43Å; S136-P469 PolarHBondContact OG-O 3.15Å; R324-P469 PolarHBondContact NH1-O 3.26Å; R324-P469 PolarHBondContact NH2-O 3.29Å; R324-P469 VanDerWaalsContact NH2-O 3.09Å; L429-P469 HydrophobicContact CD1-CG 4.38Å; L429-P469 HydrophobicContact CD2-CG 4Å; P469-I473 HydrophobicContact CB-CD1 4.23Å; P469-I473 HydrophobicContact CG-CD1 4.4Å; P469-I473 HydrophobicContact CG-CG2 4.46Å
470	P	98.9	Very high	97	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.199	C	C	.	.			trans	-60.3	147.7	171.5	-26.1	37.1	0	0	0	111.2	I121 D133 S136 V141 V472 I473	I121-P470 HydrophobicContact CG2-CB 4.14Å; I121-P470 HydrophobicContact CG2-CG 4.4Å; D133-P470 VanDerWaalsContact O-CD 3.27Å; D133-P470 WeakPolarHBondContact O-CD 3.42Å; S136-P470 WeakPolarHBondContact OG-CD 3.35Å; V141-P470 VanDerWaalsContact O-CB 3.29Å; V141-P470 WeakPolarHBondContact O-CB 3.42Å; P470-V472 HydrophobicContact CB-CG2 4.18Å; P470-V472 PolarHBondContact O-N 3.14Å; P470-I473 WeakPolarHBondContact O-CB 3.35Å; P470-I473 WeakPolarHBondContact O-CG2 3.37Å; P470-I473 PolarHBondContact O-N 2.85Å
471	L	98.9	Very high	97.3	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-10.3	-170.8	-50.8	-174	0	0	0	113.1	N142 A323 R324 L398 N401 A402 L429 I473	N142-L471 HydrophobicContact CB-CD1 3.74Å; N142-L471 HydrophobicContact CB-CG 3.85Å; N142-L471 WeakPolarHBondContact O-CA 3.41Å; N142-L471 WeakPolarHBondContact O-CB 3.25Å; N142-L471 PolarHBondContact O-N 3.25Å; A323-L471 HydrophobicContact CB-CD1 3.6Å; R324-L471 VanDerWaalsContact CZ-CD2 3.43Å; L398-L471 HydrophobicContact CB-CB 4.06Å; L398-L471 HydrophobicContact CB-CD1 4.11Å; L398-L471 HydrophobicContact CD1-CB 4.31Å; L398-L471 HydrophobicContact CD2-CB 4.27Å; L398-L471 HydrophobicContact CG-CB 4.45Å; N401-L471 PolarHBondContact ND2-O 2.65Å; A402-L471 HydrophobicContact CB-CD1 4.29Å; A402-L471 HydrophobicContact CB-CD2 3.9Å; L429-L471 HydrophobicContact CB-CD2 3.74Å; L429-L471 HydrophobicContact CD1-CD2 3.81Å; L429-L471 HydrophobicContact CG-CD2 4.37Å; L471-I473 PolarHBondContact O-N 2.77Å
472	V	98.8	Very high	98	Very high	34 Å²	34	34.3 Å²	34.3	21%	0.206	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-3.6	174.2	-62	0	0	0	0	113.1	I121 Q143 E396 L398 P470 R474	I121-V472 HydrophobicContact CG2-CG2 3.89Å; Q143-V472 WeakPolarHBondContact O-CG1 3.32Å; E396-V472 WeakPolarHBondContact OE2-CG1 3.46Å; L398-V472 HydrophobicContact CD2-CG1 3.85Å; P470-V472 HydrophobicContact CB-CG2 4.18Å; P470-V472 PolarHBondContact O-N 3.14Å; V472-R474 PolarHBondContact O-N 3.28Å
473	I	98.8	Very high	98.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.165	C	C	.	.			trans	-58.4	133.1	179.3	-165.8	165.6	0	0	0	111.9	I121 F134 N401 M405 L429 P469 P470 L471 E477 L478	I121-I473 HydrophobicContact CD1-CD1 4.3Å; I121-I473 HydrophobicContact CD1-CG1 3.93Å; I121-I473 HydrophobicContact CG2-CB 3.85Å; I121-I473 HydrophobicContact CG2-CG1 4.29Å; F134-I473 HydrophobicContact CE2-CD1 4.33Å; F134-I473 HydrophobicContact CZ-CD1 4.45Å; N401-I473 PolarHBondContact ND2-O 3.18Å; M405-I473 HydrophobicContact CG-CG2 4.33Å; L429-I473 HydrophobicContact CD1-CG2 3.79Å; P469-I473 HydrophobicContact CB-CD1 4.23Å; P469-I473 HydrophobicContact CG-CD1 4.4Å; P469-I473 HydrophobicContact CG-CG2 4.46Å; P470-I473 WeakPolarHBondContact O-CB 3.35Å; P470-I473 WeakPolarHBondContact O-CG2 3.37Å; P470-I473 PolarHBondContact O-N 2.85Å; L471-I473 PolarHBondContact O-N 2.77Å; I473-E477 HydrophobicContact CD1-CB 4.41Å; I473-E477 HydrophobicContact CG1-CB 3.85Å; I473-L478 HydrophobicContact CD1-CB 4.09Å; I473-L478 HydrophobicContact CD1-CD1 4.19Å; I473-L478 HydrophobicContact CG1-CB 4.28Å
474	R	98.6	Very high	98.6	Very high	158 Å²	158	33.4 Å²	33.4	60%	0.596	15%	0.154	S	C	*	.			trans	-91.8	162.6	177.5	-59.3	173.1	178.3	178.7	0.7	110.4	V472 H476 E477 L478	V472-R474 PolarHBondContact O-N 3.28Å; R474-H476 PolarHBondContact O-N 2.62Å; R474-E477 HydrophobicContact CB-CG 4.36Å; R474-E477 VanDerWaalsContact CB-OE2 3.27Å; R474-E477 WeakPolarHBondContact CB-OE2 3.45Å; R474-E477 WeakPolarHBondContact CG-OE2 3.42Å; R474-E477 PolarHBondContact N-OE2 2.82Å; R474-E477 WeakPolarHBondContact O-CB 3.17Å; R474-E477 PolarHBondContact O-N 3.29Å; R474-L478 PolarHBondContact O-N 3.19Å
475	E	98.7	Very high	98.7	Very high	101 Å²	101	32.8 Å²	32.8	47%	0.472	15%	0.151	S	C	.	.	H	α-helix	trans	-61.1	-43.1	-175.3	-172.7	171.9	159.5	0	0	113.6	R404 M405 L408 L478 Q479	R404-E475 IonicContact CZ-OE2 2.72Å; R404-E475 IonicContact NH1-OE2 3.5Å; R404-E475 PolarHBondContact NH1-OE2 3.1Å; M405-E475 HydrophobicContact CE-CB 4Å; M405-E475 HydrophobicContact CE-CG 4.09Å; M405-E475 HydrophobicContact SD-CB 4.11Å; L408-E475 HydrophobicContact CD2-CG 3.79Å; E475-L478 PolarHBondContact O-N 3.03Å; E475-Q479 PolarHBondContact O-N 2.74Å
476	H	98.6	Very high	98.7	Very high	108 Å²	108	35.1 Å²	35.1	50%	0.5	16%	0.162	S	C	.	.	H	α-helix	trans	-65.8	-39.1	177.6	68.9	-81.7	0	0	0	112.2	R474 L478 Q479 E480	R474-H476 PolarHBondContact O-N 2.62Å; H476-L478 VanDerWaalsContact C-N 3.35Å; H476-Q479 PolarHBondContact O-N 3.06Å; H476-E480 WeakPolarHBondContact O-CG 3.27Å; H476-E480 PolarHBondContact O-N 2.97Å
477	E	98.8	Very high	98.7	Very high	25 Å²	25	42.3 Å²	42.3	12%	0.117	19%	0.189	C	C	.	.	H	α-helix	trans	-64.1	-41.9	175.1	-64.7	164.8	156.8	0	0	110.6	I121 Y132 I473 R474 Q479 E480 C481	I121-E477 HydrophobicContact CD1-CB 3.67Å; I121-E477 HydrophobicContact CD1-CG 3.8Å; I121-E477 WeakPolarHBondContact CD1-OE2 3.3Å; Y132-E477 HydrophobicContact CE1-CB 4.12Å; I473-E477 HydrophobicContact CD1-CB 4.41Å; I473-E477 HydrophobicContact CG1-CB 3.85Å; R474-E477 HydrophobicContact CB-CG 4.36Å; R474-E477 VanDerWaalsContact CB-OE2 3.27Å; R474-E477 WeakPolarHBondContact CB-OE2 3.45Å; R474-E477 WeakPolarHBondContact CG-OE2 3.42Å; R474-E477 PolarHBondContact N-OE2 2.82Å; R474-E477 WeakPolarHBondContact O-CB 3.17Å; R474-E477 PolarHBondContact O-N 3.29Å; E477-Q479 VanDerWaalsContact C-N 3.34Å; E477-E480 PolarHBondContact O-N 3.37Å; E477-C481 PolarHBondContact O-N 3.1Å; E477-C481 VanDerWaalsContact O-N 3.08Å; E477-C481 PolarHBondContact O-SG 3.07Å
478	L	98.8	Very high	98.7	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-64.7	-38.8	175.2	-178.1	63.4	0	0	0	111.7	F134 M405 L408 L409 I473 R474 E475 H476 C481 I482	F134-L478 HydrophobicContact CZ-CD1 4.15Å; M405-L478 HydrophobicContact CB-CD2 3.81Å; M405-L478 HydrophobicContact CG-CD2 4.31Å; M405-L478 VanDerWaalsContact O-CD2 3.31Å; M405-L478 WeakPolarHBondContact O-CD2 3.49Å; M405-L478 HydrophobicContact SD-CB 4.34Å; M405-L478 HydrophobicContact SD-CD2 3.77Å; L408-L478 HydrophobicContact CB-CD2 4.29Å; L408-L478 HydrophobicContact CD2-CD2 4.06Å; L408-L478 HydrophobicContact CG-CD2 4.24Å; L409-L478 HydrophobicContact CB-CD1 4.33Å; L409-L478 HydrophobicContact CB-CD2 4.31Å; L409-L478 HydrophobicContact CD1-CD1 4.18Å; I473-L478 HydrophobicContact CD1-CB 4.09Å; I473-L478 HydrophobicContact CD1-CD1 4.19Å; I473-L478 HydrophobicContact CG1-CB 4.28Å; R474-L478 PolarHBondContact O-N 3.19Å; E475-L478 PolarHBondContact O-N 3.03Å; H476-L478 VanDerWaalsContact C-N 3.35Å; L478-C481 WeakPolarHBondContact O-CB 3.49Å; L478-C481 PolarHBondContact O-N 3.11Å; L478-I482 HydrophobicContact CD1-CD1 4.46Å; L478-I482 HydrophobicContact CG-CD1 3.92Å; L478-I482 HydrophobicContact CG-CG1 4.48Å; L478-I482 VanDerWaalsContact O-CG1 3.29Å; L478-I482 WeakPolarHBondContact O-CG1 3.3Å; L478-I482 PolarHBondContact O-N 3.35Å
479	Q	98.7	Very high	98.7	Very high	72 Å²	72	42.1 Å²	42.1	34%	0.336	19%	0.188	S	C	.	.	H	α-helix	trans	-62.7	-43.6	176.1	-172.3	60.7	58.7	0	0	111.3	E475 H476 E477 C481 I482 D483	E475-Q479 PolarHBondContact O-N 2.74Å; H476-Q479 PolarHBondContact O-N 3.06Å; E477-Q479 VanDerWaalsContact C-N 3.34Å; Q479-C481 VanDerWaalsContact C-N 3.28Å; Q479-C481 PolarHBondContact O-N 2.71Å; Q479-I482 WeakPolarHBondContact O-CB 3.23Å; Q479-I482 PolarHBondContact O-N 2.83Å; Q479-D483 PolarHBondContact NE2-OD1 2.96Å; Q479-D483 VanDerWaalsContact O-CG 3.27Å; Q479-D483 PolarHBondContact O-N 3.26Å
480	E	98.8	Very high	98.6	Very high	89 Å²	89	47.1 Å²	47.1	42%	0.416	21%	0.212	S	C	.	.	H	α-helix	trans	-57.8	-41.6	172.6	-70.3	177.2	-154.5	0	0	111.9	Y132 H476 E477 D483 I484	Y132-E480 HydrophobicContact CE2-CB 4.43Å; Y132-E480 PolarHBondContact OH-OE2 2.9Å; H476-E480 WeakPolarHBondContact O-CG 3.27Å; H476-E480 PolarHBondContact O-N 2.97Å; E477-E480 PolarHBondContact O-N 3.37Å; E480-D483 PolarHBondContact O-N 3.28Å; E480-I484 WeakPolarHBondContact O-CG1 3.16Å; E480-I484 PolarHBondContact O-N 3.34Å
481	C	98.8	Very high	98.5	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65.2	-41.2	176.6	-62.3	0	0	0	0	112.2	Y132 F134 L455 E477 L478 Q479 D483 I484 I485	Y132-C481 WeakPolarHBondContact CD1-SG 3.43Å; F134-C481 HydrophobicContact CE1-CB 4.36Å; F134-C481 HydrophobicContact CE2-CB 3.67Å; F134-C481 WeakPolarHBondContact CE2-SG 3.37Å; F134-C481 HydrophobicContact CZ-CB 3.38Å; L455-C481 HydrophobicContact CD1-CB 3.95Å; E477-C481 PolarHBondContact O-N 3.1Å; E477-C481 VanDerWaalsContact O-N 3.08Å; E477-C481 PolarHBondContact O-SG 3.07Å; L478-C481 WeakPolarHBondContact O-CB 3.49Å; L478-C481 PolarHBondContact O-N 3.11Å; Q479-C481 VanDerWaalsContact C-N 3.28Å; Q479-C481 PolarHBondContact O-N 2.71Å; C481-D483 VanDerWaalsContact C-N 3.31Å; C481-D483 PolarHBondContact O-N 3.12Å; C481-I484 WeakPolarHBondContact O-CB 3.29Å; C481-I484 PolarHBondContact O-N 3.17Å; C481-I485 WeakPolarHBondContact O-CD1 3.35Å; C481-I485 VanDerWaalsContact O-CG1 3.25Å; C481-I485 WeakPolarHBondContact O-CG1 3.49Å; C481-I485 PolarHBondContact O-N 3.17Å
482	I	98.8	Very high	98.3	Very high	1 Å²	1	54 Å²	54	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-60.5	-44.1	175.6	-72.8	162	0	0	0	109.8	L408 L409 E412 L478 Q479 I484 I485 Q486	L408-I482 HydrophobicContact CG-CD1 4.33Å; L409-I482 HydrophobicContact CD1-CD1 4.39Å; L409-I482 HydrophobicContact CD1-CG1 3.89Å; E412-I482 HydrophobicContact CB-CD1 4.01Å; E412-I482 HydrophobicContact CB-CG1 4.31Å; E412-I482 HydrophobicContact CB-CG2 3.58Å; E412-I482 HydrophobicContact CG-CD1 3.9Å; E412-I482 HydrophobicContact CG-CG2 3.98Å; L478-I482 HydrophobicContact CD1-CD1 4.46Å; L478-I482 HydrophobicContact CG-CD1 3.92Å; L478-I482 HydrophobicContact CG-CG1 4.48Å; L478-I482 VanDerWaalsContact O-CG1 3.29Å; L478-I482 WeakPolarHBondContact O-CG1 3.3Å; L478-I482 PolarHBondContact O-N 3.35Å; Q479-I482 WeakPolarHBondContact O-CB 3.23Å; Q479-I482 PolarHBondContact O-N 2.83Å; I482-I484 VanDerWaalsContact C-N 3.32Å; I482-I484 PolarHBondContact O-N 2.78Å; I482-I485 PolarHBondContact O-N 3.46Å; I482-Q486 HydrophobicContact CG2-CG 4.27Å; I482-Q486 WeakPolarHBondContact O-CB 3.46Å; I482-Q486 WeakPolarHBondContact O-CG 3.38Å; I482-Q486 PolarHBondContact O-N 2.68Å
483	D	98.8	Very high	98.3	Very high	68 Å²	68	55.1 Å²	55.1	36%	0.364	25%	0.253	S	S	.	.	H	α-helix	trans	-64.1	-36.5	177.6	-64.5	-6.6	0	0	0	111.9	Q479 E480 C481 R487	Q479-D483 PolarHBondContact NE2-OD1 2.96Å; Q479-D483 VanDerWaalsContact O-CG 3.27Å; Q479-D483 PolarHBondContact O-N 3.26Å; E480-D483 PolarHBondContact O-N 3.28Å; C481-D483 VanDerWaalsContact C-N 3.31Å; C481-D483 PolarHBondContact O-N 3.12Å; D483-R487 WeakPolarHBondContact O-CB 3.42Å; D483-R487 VanDerWaalsContact O-CG 3.25Å; D483-R487 WeakPolarHBondContact O-CG 3.32Å; D483-R487 PolarHBondContact O-N 2.94Å; D483-R487 VanDerWaalsContact O-N 3.07Å; D483-R487 PolarHBondContact O-NE 3.26Å; D483-R487 VanDerWaalsContact O-NE 3.1Å
484	I	98.9	Very high	98.3	Very high	14 Å²	14	57.9 Å²	57.9	7%	0.072	27%	0.266	C	S	.	.	H	α-helix	trans	-63.7	-48.5	171.9	-70.9	164.7	0	0	0	110.6	Y132 L450 N453 L455 E480 C481 I482 T488	Y132-I484 HydrophobicContact CD2-CD1 4.07Å; Y132-I484 HydrophobicContact CE2-CD1 4.21Å; L450-I484 HydrophobicContact CD2-CG2 4.36Å; N453-I484 HydrophobicContact CB-CG2 3.86Å; L455-I484 HydrophobicContact CB-CG2 3.87Å; L455-I484 HydrophobicContact CD1-CG2 4.38Å; E480-I484 WeakPolarHBondContact O-CG1 3.16Å; E480-I484 PolarHBondContact O-N 3.34Å; C481-I484 WeakPolarHBondContact O-CB 3.29Å; C481-I484 PolarHBondContact O-N 3.17Å; I482-I484 VanDerWaalsContact C-N 3.32Å; I482-I484 PolarHBondContact O-N 2.78Å; I484-T488 VanDerWaalsContact O-CB 3.3Å; I484-T488 WeakPolarHBondContact O-CB 3.43Å; I484-T488 PolarHBondContact O-N 3.31Å; I484-T488 PolarHBondContact O-OG1 3.16Å
485	I	98.8	Very high	98.3	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-62.5	-48.7	-178.9	-66.8	161	0	0	0	110.2	F134 L413 L416 L450 L455 L467 C481 I482 T488 I489	F134-I485 HydrophobicContact CD1-CD1 4.47Å; F134-I485 HydrophobicContact CE1-CD1 4.07Å; L413-I485 HydrophobicContact CD2-CD1 4.41Å; L413-I485 HydrophobicContact CD2-CG2 3.69Å; L416-I485 HydrophobicContact CD1-CG2 4.36Å; L450-I485 HydrophobicContact CD2-CB 4.49Å; L450-I485 HydrophobicContact CD2-CG1 4.06Å; L455-I485 HydrophobicContact CD1-CD1 4.08Å; L455-I485 HydrophobicContact CD1-CG1 3.93Å; L467-I485 HydrophobicContact CD1-CD1 4.29Å; L467-I485 HydrophobicContact CD2-CD1 4.29Å; C481-I485 WeakPolarHBondContact O-CD1 3.35Å; C481-I485 VanDerWaalsContact O-CG1 3.25Å; C481-I485 WeakPolarHBondContact O-CG1 3.49Å; C481-I485 PolarHBondContact O-N 3.17Å; I482-I485 PolarHBondContact O-N 3.46Å; I485-T488 PolarHBondContact O-N 3.3Å; I485-I489 HydrophobicContact CG2-CG1 4.24Å; I485-I489 WeakPolarHBondContact O-CB 3.45Å; I485-I489 VanDerWaalsContact O-CG1 3.3Å; I485-I489 WeakPolarHBondContact O-CG1 3.26Å; I485-I489 PolarHBondContact O-N 2.9Å
486	Q	98.5	Very high	98.2	Very high	49 Å²	49	49.5 Å²	49.5	23%	0.229	24%	0.235	C	C	.	.	H	α-helix	trans	-59.7	-52	179.4	-73.8	178.8	-7.7	0	0	111.5	L416 I482 T488 I489 M490	L416-Q486 HydrophobicContact CD2-CB 4.29Å; L416-Q486 HydrophobicContact CD2-CG 3.77Å; I482-Q486 HydrophobicContact CG2-CG 4.27Å; I482-Q486 WeakPolarHBondContact O-CB 3.46Å; I482-Q486 WeakPolarHBondContact O-CG 3.38Å; I482-Q486 PolarHBondContact O-N 2.68Å; Q486-T488 PolarHBondContact O-N 3.15Å; Q486-I489 PolarHBondContact O-N 3.19Å; Q486-M490 WeakPolarHBondContact O-CB 3.49Å; Q486-M490 WeakPolarHBondContact O-CG 3.16Å; Q486-M490 PolarHBondContact O-N 3.41Å
487	R	98.4	Very high	98.2	Very high	162 Å²	162	45.9 Å²	45.9	61%	0.611	22%	0.218	S	C	*	.	H	α-helix	trans	-59.9	-36.4	178.1	-72.7	-179	-61.4	162.4	2.9	112.7	D483 S491	D483-R487 WeakPolarHBondContact O-CB 3.42Å; D483-R487 VanDerWaalsContact O-CG 3.25Å; D483-R487 WeakPolarHBondContact O-CG 3.32Å; D483-R487 PolarHBondContact O-N 2.94Å; D483-R487 VanDerWaalsContact O-N 3.07Å; D483-R487 PolarHBondContact O-NE 3.26Å; D483-R487 VanDerWaalsContact O-NE 3.1Å; R487-S491 PolarHBondContact O-N 2.93Å
488	T	98.6	Very high	98.2	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-66.1	-50.2	177	-59.7	0	0	0	0	111.3	V446 R449 L450 N453 I484 I485 Q486 M490 S491 F492	V446-T488 HydrophobicContact CG1-CG2 4.45Å; R449-T488 HydrophobicContact CB-CG2 3.75Å; R449-T488 HydrophobicContact CG-CG2 3.55Å; L450-T488 HydrophobicContact CD2-CG2 3.74Å; L450-T488 HydrophobicContact CG-CG2 3.8Å; N453-T488 PolarHBondContact ND2-OG1 3.23Å; I484-T488 VanDerWaalsContact O-CB 3.3Å; I484-T488 WeakPolarHBondContact O-CB 3.43Å; I484-T488 PolarHBondContact O-N 3.31Å; I484-T488 PolarHBondContact O-OG1 3.16Å; I485-T488 PolarHBondContact O-N 3.3Å; Q486-T488 PolarHBondContact O-N 3.15Å; T488-M490 VanDerWaalsContact C-N 3.35Å; T488-M490 PolarHBondContact O-N 2.83Å; T488-S491 WeakPolarHBondContact O-CB 3.41Å; T488-S491 PolarHBondContact O-N 2.8Å; T488-S491 VanDerWaalsContact O-N 3.17Å; T488-S491 PolarHBondContact O-OG 3.03Å; T488-F492 HydrophobicContact CG2-CE2 4.27Å; T488-F492 VanDerWaalsContact O-CD2 3.29Å; T488-F492 WeakPolarHBondContact O-CD2 3.34Å
489	I	98.1	Very high	98.1	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-63.2	-41.2	-179.4	-67.7	-68	0	0	0	111.2	L416 I420 V421 I433 I435 V446 I485 Q486 S491 F492	L416-I489 HydrophobicContact CD1-CG1 4.26Å; L416-I489 HydrophobicContact CD2-CB 4.11Å; L416-I489 HydrophobicContact CD2-CG1 4.47Å; L416-I489 HydrophobicContact CD2-CG2 4.04Å; I420-I489 HydrophobicContact CB-CG2 4.31Å; I420-I489 HydrophobicContact CD1-CG2 4.29Å; I420-I489 WeakPolarHBondContact CD1-O 3.35Å; I420-I489 HydrophobicContact CG2-CG2 3.96Å; V421-I489 HydrophobicContact CG2-CD1 4.16Å; V421-I489 HydrophobicContact CG2-CG2 4.06Å; I433-I489 HydrophobicContact CD1-CD1 4.3Å; I435-I489 HydrophobicContact CD1-CD1 4.05Å; V446-I489 HydrophobicContact CG1-CD1 3.73Å; I485-I489 HydrophobicContact CG2-CG1 4.24Å; I485-I489 WeakPolarHBondContact O-CB 3.45Å; I485-I489 VanDerWaalsContact O-CG1 3.3Å; I485-I489 WeakPolarHBondContact O-CG1 3.26Å; I485-I489 PolarHBondContact O-N 2.9Å; Q486-I489 PolarHBondContact O-N 3.19Å; I489-S491 PolarHBondContact O-N 3.16Å; I489-S491 VanDerWaalsContact O-N 3.15Å; I489-F492 PolarHBondContact O-N 3.41Å
490	M	97.3	Very high	98.1	Very high	105 Å²	105	49 Å²	49	52%	0.517	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-4.7	178.4	-62	-65	166.2	0	0	114.4	L416 P417 Q486 T488	L416-M490 HydrophobicContact CD2-CE 4.13Å; P417-M490 HydrophobicContact CG-CE 3.41Å; P417-M490 VanDerWaalsContact CG-CE 3.41Å; P417-M490 HydrophobicContact CG-SD 3.43Å; P417-M490 WeakPolarHBondContact CG-SD 3.43Å; Q486-M490 WeakPolarHBondContact O-CB 3.49Å; Q486-M490 WeakPolarHBondContact O-CG 3.16Å; Q486-M490 PolarHBondContact O-N 3.41Å; T488-M490 VanDerWaalsContact C-N 3.35Å; T488-M490 PolarHBondContact O-N 2.83Å
491	S	97.1	Very high	98.1	Very high	64 Å²	64	45.7 Å²	45.7	45%	0.448	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-4.5	176.9	75.5	0	0	0	0	113.9	R487 T488 I489	R487-S491 PolarHBondContact O-N 2.93Å; T488-S491 WeakPolarHBondContact O-CB 3.41Å; T488-S491 PolarHBondContact O-N 2.8Å; T488-S491 VanDerWaalsContact O-N 3.17Å; T488-S491 PolarHBondContact O-OG 3.03Å; I489-S491 PolarHBondContact O-N 3.16Å; I489-S491 VanDerWaalsContact O-N 3.15Å
492	F	94.6	Very high	98	Very high	82 Å²	82	49.8 Å²	49.8	36%	0.36	24%	0.238	S	C	.	.			trans	-106	0	171.6	-62.7	-80	0	0	0	109.4	I420 Y441 K445 V446 R449 T488 I489	I420-F492 VanDerWaalsContact CD1-OXT 3.26Å; I420-F492 WeakPolarHBondContact CD1-OXT 3.03Å; Y441-F492 HydrophobicContact CD1-CB 3.78Å; Y441-F492 AromaticContact CD1-CD1 3.94Å; Y441-F492 HydrophobicContact CD1-CD1 3.94Å; Y441-F492 HydrophobicContact CD1-CG 4.23Å; Y441-F492 HydrophobicContact CD2-CB 4.46Å; Y441-F492 HydrophobicContact CD2-CD1 4.46Å; Y441-F492 HydrophobicContact CE1-CB 3.92Å; Y441-F492 HydrophobicContact CG-CB 4.05Å; Y441-F492 AromaticContact CG-CD1 3.69Å; Y441-F492 HydrophobicContact CG-CD1 3.69Å; Y441-F492 HydrophobicContact CG-CE1 4.43Å; Y441-F492 HydrophobicContact CG-CG 4.07Å; K445-F492 HydrophobicContact CB-CE1 4.36Å; V446-F492 HydrophobicContact CB-CE2 4.28Å; V446-F492 HydrophobicContact CG2-CD2 4.05Å; V446-F492 HydrophobicContact CG2-CE2 3.74Å; V446-F492 HydrophobicContact CG2-CZ 4.09Å; R449-F492 HydrophobicContact CB-CE2 4.18Å; R449-F492 HydrophobicContact CB-CZ 4.03Å; R449-F492 HydrophobicContact CG-CE2 4.39Å; T488-F492 HydrophobicContact CG2-CE2 4.27Å; T488-F492 VanDerWaalsContact O-CD2 3.29Å; T488-F492 WeakPolarHBondContact O-CD2 3.34Å; I489-F492 PolarHBondContact O-N 3.41Å

Retrieved 492 of 492 residues in 427.9 ms (Link to these results)

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